USER MOD reduce.3.24.130724 H: found=0, std=0, add=1113, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1112 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 145 ASN :FLIP amide:sc= 0 F(o=-0.51,f=0.026) USER MOD Set 1.2: A 146 SER OG : rot 180:sc= 0.0265 USER MOD Set 2.1: A 17 TYR OH : rot 51:sc= -0.725 USER MOD Set 2.2: A 125 SER OG : rot 136:sc= 1.11 USER MOD Set 3.1: A 30 ASN : amide:sc= 0.00988 X(o=0.0099,f=0) USER MOD Set 3.2: A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 HIS : no HD1:sc= -0.6 K(o=-0.6,f=-2.7!) USER MOD Single : A 20 MET CE :methyl -158:sc= -5.32! (180deg=-7.7!) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 HIS : no HD1:sc= -5.86! C(o=-5.9!,f=-8.1!) USER MOD Single : A 27 ASN : amide:sc= 0.385 K(o=0.38,f=-3.3!) USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 43:sc= 0.985 USER MOD Single : A 34 SER OG : rot 180:sc= 0.0355 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0.0112 USER MOD Single : A 41 LYS NZ :NH3+ 170:sc= 0.0457 (180deg=0.0185) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 TYR OH : rot -149:sc= -0.561 USER MOD Single : A 46 THR OG1 : rot -41:sc= -4.53! USER MOD Single : A 47 THR OG1 : rot -150:sc= -0.199 USER MOD Single : A 52 CYS SG : rot -140:sc= 0 USER MOD Single : A 55 THR OG1 : rot 105:sc= 2.03 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot -159:sc= -1.1 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 THR OG1 : rot -110:sc= -0.26 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 151:sc= -0.377 (180deg=-1.41!) USER MOD Single : A 96 CYS SG : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 100:sc= -0.128 USER MOD Single : A 102 CYS SG : rot -155:sc= -2.63! USER MOD Single : A 106 HIS :FLIP no HD1:sc= -2.95 F(o=-4.7!,f=-2.9) USER MOD Single : A 107 CYS SG : rot 180:sc= -1.29 USER MOD Single : A 127 MET CE :methyl 137:sc= -7.35! (180deg=-16.5!) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 134 GLN : amide:sc= -0.231 X(o=-0.23,f=-0.07) USER MOD Single : A 138 GLN : amide:sc= -0.142 K(o=-0.14,f=-1.6!) USER MOD Single : A 139 LYS NZ :NH3+ -124:sc= -0.557 (180deg=-3.43!) USER MOD Single : A 147 LYS NZ :NH3+ -164:sc= -2.07 (180deg=-2.42!) USER MOD Single : A 148 GLN : amide:sc= -2.62! C(o=-2.6!,f=-4.7!) USER MOD Single : A 150 THR OG1 : rot 85:sc= 0.369 USER MOD Single : A 151 TYR OH : rot 52:sc= -5.31! USER MOD Single : A 154 LYS NZ :NH3+ -122:sc= 0.749 (180deg=-0.513) USER MOD Single : A 155 TYR OH : rot 30:sc= -0.502 USER MOD ----------------------------------------------------------------- ATOM 158 N ALA A 11 -12.650 5.221 -10.778 1.00 0.00 N ATOM 159 CA ALA A 11 -13.396 4.333 -9.894 1.00 0.00 C ATOM 160 C ALA A 11 -12.475 3.671 -8.874 1.00 0.00 C ATOM 161 O ALA A 11 -11.319 3.371 -9.172 1.00 0.00 O ATOM 162 CB ALA A 11 -14.133 3.278 -10.707 1.00 0.00 C ATOM 0 HA ALA A 11 -14.126 4.932 -9.349 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -14.686 2.622 -10.035 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -14.828 3.765 -11.391 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -13.414 2.690 -11.278 1.00 0.00 H new ATOM 168 N PRO A 12 -12.976 3.433 -7.648 1.00 0.00 N ATOM 169 CA PRO A 12 -12.191 2.805 -6.582 1.00 0.00 C ATOM 170 C PRO A 12 -11.978 1.313 -6.821 1.00 0.00 C ATOM 171 O PRO A 12 -12.652 0.705 -7.652 1.00 0.00 O ATOM 172 CB PRO A 12 -13.047 3.028 -5.335 1.00 0.00 C ATOM 173 CG PRO A 12 -14.442 3.118 -5.849 1.00 0.00 C ATOM 174 CD PRO A 12 -14.346 3.760 -7.207 1.00 0.00 C ATOM 0 HA PRO A 12 -11.189 3.228 -6.510 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -12.938 2.207 -4.627 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -12.757 3.940 -4.813 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -14.897 2.130 -5.916 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -15.066 3.711 -5.181 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -15.094 3.362 -7.893 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -14.504 4.837 -7.154 1.00 0.00 H new ATOM 182 N VAL A 13 -11.037 0.728 -6.084 1.00 0.00 N ATOM 183 CA VAL A 13 -10.740 -0.693 -6.214 1.00 0.00 C ATOM 184 C VAL A 13 -10.458 -1.310 -4.851 1.00 0.00 C ATOM 185 O VAL A 13 -9.622 -0.815 -4.096 1.00 0.00 O ATOM 186 CB VAL A 13 -9.531 -0.936 -7.138 1.00 0.00 C ATOM 187 CG1 VAL A 13 -9.391 -2.416 -7.454 1.00 0.00 C ATOM 188 CG2 VAL A 13 -9.662 -0.121 -8.415 1.00 0.00 C ATOM 0 H VAL A 13 -10.469 1.217 -5.392 1.00 0.00 H new ATOM 0 HA VAL A 13 -11.618 -1.165 -6.655 1.00 0.00 H new ATOM 0 HB VAL A 13 -8.629 -0.612 -6.619 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -8.532 -2.569 -8.108 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -9.247 -2.974 -6.529 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -10.294 -2.769 -7.953 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -8.799 -0.306 -9.055 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -10.572 -0.411 -8.940 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -9.709 0.939 -8.167 1.00 0.00 H new ATOM 198 N GLU A 14 -11.167 -2.388 -4.533 1.00 0.00 N ATOM 199 CA GLU A 14 -10.994 -3.056 -3.252 1.00 0.00 C ATOM 200 C GLU A 14 -10.313 -4.413 -3.413 1.00 0.00 C ATOM 201 O GLU A 14 -10.857 -5.325 -4.036 1.00 0.00 O ATOM 202 CB GLU A 14 -12.349 -3.234 -2.564 1.00 0.00 C ATOM 203 CG GLU A 14 -13.396 -3.900 -3.443 1.00 0.00 C ATOM 204 CD GLU A 14 -14.104 -5.043 -2.743 1.00 0.00 C ATOM 205 OE1 GLU A 14 -13.466 -5.714 -1.906 1.00 0.00 O ATOM 206 OE2 GLU A 14 -15.299 -5.267 -3.032 1.00 0.00 O ATOM 0 H GLU A 14 -11.864 -2.815 -5.143 1.00 0.00 H new ATOM 0 HA GLU A 14 -10.351 -2.428 -2.635 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -12.213 -3.829 -1.661 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -12.718 -2.258 -2.250 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -14.131 -3.157 -3.752 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -12.920 -4.273 -4.350 1.00 0.00 H new ATOM 213 N VAL A 15 -9.127 -4.543 -2.824 1.00 0.00 N ATOM 214 CA VAL A 15 -8.374 -5.792 -2.876 1.00 0.00 C ATOM 215 C VAL A 15 -8.421 -6.475 -1.513 1.00 0.00 C ATOM 216 O VAL A 15 -7.969 -5.913 -0.517 1.00 0.00 O ATOM 217 CB VAL A 15 -6.899 -5.565 -3.281 1.00 0.00 C ATOM 218 CG1 VAL A 15 -6.395 -6.716 -4.139 1.00 0.00 C ATOM 219 CG2 VAL A 15 -6.731 -4.240 -4.014 1.00 0.00 C ATOM 0 H VAL A 15 -8.666 -3.796 -2.304 1.00 0.00 H new ATOM 0 HA VAL A 15 -8.837 -6.423 -3.635 1.00 0.00 H new ATOM 0 HB VAL A 15 -6.303 -5.526 -2.369 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -5.355 -6.537 -4.413 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -6.467 -7.647 -3.577 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -7.001 -6.789 -5.042 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -5.684 -4.106 -4.287 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -7.344 -4.243 -4.915 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -7.044 -3.423 -3.365 1.00 0.00 H new ATOM 229 N SER A 16 -8.986 -7.678 -1.466 1.00 0.00 N ATOM 230 CA SER A 16 -9.099 -8.407 -0.208 1.00 0.00 C ATOM 231 C SER A 16 -8.839 -9.895 -0.394 1.00 0.00 C ATOM 232 O SER A 16 -9.208 -10.480 -1.412 1.00 0.00 O ATOM 233 CB SER A 16 -10.489 -8.197 0.395 1.00 0.00 C ATOM 234 OG SER A 16 -11.504 -8.599 -0.508 1.00 0.00 O ATOM 0 H SER A 16 -9.369 -8.165 -2.276 1.00 0.00 H new ATOM 0 HA SER A 16 -8.341 -8.016 0.470 1.00 0.00 H new ATOM 0 HB2 SER A 16 -10.576 -8.765 1.321 1.00 0.00 H new ATOM 0 HB3 SER A 16 -10.622 -7.146 0.652 1.00 0.00 H new ATOM 0 HG SER A 16 -12.382 -8.456 -0.098 1.00 0.00 H new ATOM 240 N TYR A 17 -8.217 -10.505 0.607 1.00 0.00 N ATOM 241 CA TYR A 17 -7.921 -11.930 0.567 1.00 0.00 C ATOM 242 C TYR A 17 -8.099 -12.552 1.952 1.00 0.00 C ATOM 243 O TYR A 17 -7.477 -12.117 2.920 1.00 0.00 O ATOM 244 CB TYR A 17 -6.502 -12.164 0.024 1.00 0.00 C ATOM 245 CG TYR A 17 -5.465 -12.503 1.074 1.00 0.00 C ATOM 246 CD1 TYR A 17 -4.963 -11.529 1.926 1.00 0.00 C ATOM 247 CD2 TYR A 17 -4.986 -13.799 1.206 1.00 0.00 C ATOM 248 CE1 TYR A 17 -4.013 -11.840 2.880 1.00 0.00 C ATOM 249 CE2 TYR A 17 -4.037 -14.117 2.159 1.00 0.00 C ATOM 250 CZ TYR A 17 -3.554 -13.134 2.992 1.00 0.00 C ATOM 251 OH TYR A 17 -2.609 -13.446 3.944 1.00 0.00 O ATOM 0 H TYR A 17 -7.908 -10.034 1.457 1.00 0.00 H new ATOM 0 HA TYR A 17 -8.623 -12.418 -0.108 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -6.537 -12.973 -0.706 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -6.180 -11.269 -0.508 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -5.320 -10.513 1.842 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -5.362 -14.573 0.552 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -3.632 -11.071 3.536 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -3.677 -15.131 2.249 1.00 0.00 H new ATOM 0 HH TYR A 17 -2.902 -13.113 4.818 1.00 0.00 H new ATOM 261 N LYS A 18 -8.965 -13.562 2.029 1.00 0.00 N ATOM 262 CA LYS A 18 -9.260 -14.264 3.282 1.00 0.00 C ATOM 263 C LYS A 18 -10.326 -13.524 4.096 1.00 0.00 C ATOM 264 O LYS A 18 -11.517 -13.805 3.962 1.00 0.00 O ATOM 265 CB LYS A 18 -7.993 -14.478 4.122 1.00 0.00 C ATOM 266 CG LYS A 18 -6.885 -15.194 3.372 1.00 0.00 C ATOM 267 CD LYS A 18 -7.148 -16.688 3.279 1.00 0.00 C ATOM 268 CE LYS A 18 -6.689 -17.253 1.945 1.00 0.00 C ATOM 269 NZ LYS A 18 -7.480 -18.451 1.548 1.00 0.00 N ATOM 0 H LYS A 18 -9.483 -13.918 1.226 1.00 0.00 H new ATOM 0 HA LYS A 18 -9.654 -15.245 3.015 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -7.624 -13.510 4.463 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -8.249 -15.053 5.012 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -6.795 -14.777 2.369 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -5.934 -15.022 3.876 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -6.630 -17.201 4.090 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -8.213 -16.880 3.409 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -6.780 -16.486 1.175 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -5.634 -17.519 2.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -7.136 -18.806 0.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -7.373 -19.192 2.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -8.484 -18.192 1.464 1.00 0.00 H new ATOM 283 N HIS A 19 -9.901 -12.588 4.945 1.00 0.00 N ATOM 284 CA HIS A 19 -10.839 -11.836 5.774 1.00 0.00 C ATOM 285 C HIS A 19 -10.607 -10.330 5.668 1.00 0.00 C ATOM 286 O HIS A 19 -11.557 -9.549 5.622 1.00 0.00 O ATOM 287 CB HIS A 19 -10.723 -12.275 7.234 1.00 0.00 C ATOM 288 CG HIS A 19 -9.310 -12.349 7.726 1.00 0.00 C ATOM 289 ND1 HIS A 19 -8.394 -13.264 7.252 1.00 0.00 N ATOM 290 CD2 HIS A 19 -8.655 -11.614 8.657 1.00 0.00 C ATOM 291 CE1 HIS A 19 -7.240 -13.092 7.868 1.00 0.00 C ATOM 292 NE2 HIS A 19 -7.371 -12.097 8.726 1.00 0.00 N ATOM 0 H HIS A 19 -8.922 -12.335 5.075 1.00 0.00 H new ATOM 0 HA HIS A 19 -11.843 -12.048 5.407 1.00 0.00 H new ATOM 0 HB2 HIS A 19 -11.281 -11.579 7.860 1.00 0.00 H new ATOM 0 HB3 HIS A 19 -11.191 -13.253 7.349 1.00 0.00 H new ATOM 0 HD2 HIS A 19 -9.066 -10.800 9.236 1.00 0.00 H new ATOM 0 HE1 HIS A 19 -6.341 -13.667 7.699 1.00 0.00 H new ATOM 0 HE2 HIS A 19 -6.637 -11.744 9.341 1.00 0.00 H new ATOM 300 N MET A 20 -9.341 -9.926 5.640 1.00 0.00 N ATOM 301 CA MET A 20 -8.992 -8.511 5.555 1.00 0.00 C ATOM 302 C MET A 20 -9.250 -7.962 4.157 1.00 0.00 C ATOM 303 O MET A 20 -9.399 -8.720 3.198 1.00 0.00 O ATOM 304 CB MET A 20 -7.526 -8.304 5.936 1.00 0.00 C ATOM 305 CG MET A 20 -6.567 -9.213 5.184 1.00 0.00 C ATOM 306 SD MET A 20 -4.842 -8.753 5.431 1.00 0.00 S ATOM 307 CE MET A 20 -4.907 -7.002 5.065 1.00 0.00 C ATOM 0 H MET A 20 -8.540 -10.557 5.675 1.00 0.00 H new ATOM 0 HA MET A 20 -9.625 -7.967 6.256 1.00 0.00 H new ATOM 0 HB2 MET A 20 -7.253 -7.266 5.746 1.00 0.00 H new ATOM 0 HB3 MET A 20 -7.410 -8.474 7.006 1.00 0.00 H new ATOM 0 HG2 MET A 20 -6.715 -10.242 5.511 1.00 0.00 H new ATOM 0 HG3 MET A 20 -6.800 -9.180 4.120 1.00 0.00 H new ATOM 0 HE1 MET A 20 -3.913 -6.651 4.790 1.00 0.00 H new ATOM 0 HE2 MET A 20 -5.595 -6.829 4.237 1.00 0.00 H new ATOM 0 HE3 MET A 20 -5.253 -6.459 5.944 1.00 0.00 H new ATOM 317 N ARG A 21 -9.310 -6.636 4.049 1.00 0.00 N ATOM 318 CA ARG A 21 -9.561 -5.986 2.767 1.00 0.00 C ATOM 319 C ARG A 21 -8.762 -4.690 2.630 1.00 0.00 C ATOM 320 O ARG A 21 -8.256 -4.148 3.612 1.00 0.00 O ATOM 321 CB ARG A 21 -11.054 -5.691 2.605 1.00 0.00 C ATOM 322 CG ARG A 21 -11.957 -6.821 3.076 1.00 0.00 C ATOM 323 CD ARG A 21 -13.400 -6.363 3.212 1.00 0.00 C ATOM 324 NE ARG A 21 -14.337 -7.330 2.644 1.00 0.00 N ATOM 325 CZ ARG A 21 -15.593 -7.038 2.313 1.00 0.00 C ATOM 326 NH1 ARG A 21 -16.065 -5.811 2.491 1.00 0.00 N ATOM 327 NH2 ARG A 21 -16.378 -7.976 1.801 1.00 0.00 N ATOM 0 H ARG A 21 -9.188 -5.994 4.832 1.00 0.00 H new ATOM 0 HA ARG A 21 -9.238 -6.670 1.982 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -11.299 -4.787 3.162 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -11.262 -5.485 1.555 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -11.902 -7.650 2.370 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -11.601 -7.196 4.036 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -13.633 -6.208 4.265 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -13.524 -5.402 2.713 1.00 0.00 H new ATOM 0 HE ARG A 21 -14.010 -8.284 2.492 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -15.465 -5.086 2.883 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -17.028 -5.593 2.236 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -16.019 -8.921 1.661 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -17.340 -7.753 1.547 1.00 0.00 H new ATOM 341 N PHE A 22 -8.663 -4.205 1.396 1.00 0.00 N ATOM 342 CA PHE A 22 -7.939 -2.972 1.094 1.00 0.00 C ATOM 343 C PHE A 22 -8.758 -2.110 0.140 1.00 0.00 C ATOM 344 O PHE A 22 -9.410 -2.632 -0.762 1.00 0.00 O ATOM 345 CB PHE A 22 -6.581 -3.302 0.463 1.00 0.00 C ATOM 346 CG PHE A 22 -5.404 -3.037 1.359 1.00 0.00 C ATOM 347 CD1 PHE A 22 -4.922 -1.749 1.528 1.00 0.00 C ATOM 348 CD2 PHE A 22 -4.774 -4.076 2.026 1.00 0.00 C ATOM 349 CE1 PHE A 22 -3.835 -1.503 2.346 1.00 0.00 C ATOM 350 CE2 PHE A 22 -3.687 -3.836 2.844 1.00 0.00 C ATOM 351 CZ PHE A 22 -3.217 -2.547 3.004 1.00 0.00 C ATOM 0 H PHE A 22 -9.080 -4.652 0.580 1.00 0.00 H new ATOM 0 HA PHE A 22 -7.775 -2.422 2.020 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -6.573 -4.353 0.173 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -6.466 -2.719 -0.451 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -5.401 -0.928 1.015 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -5.137 -5.086 1.905 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -3.470 -0.494 2.470 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -3.205 -4.655 3.358 1.00 0.00 H new ATOM 0 HZ PHE A 22 -2.367 -2.356 3.643 1.00 0.00 H new ATOM 361 N LEU A 23 -8.723 -0.796 0.331 1.00 0.00 N ATOM 362 CA LEU A 23 -9.468 0.112 -0.536 1.00 0.00 C ATOM 363 C LEU A 23 -8.526 0.998 -1.331 1.00 0.00 C ATOM 364 O LEU A 23 -7.561 1.538 -0.796 1.00 0.00 O ATOM 365 CB LEU A 23 -10.423 0.999 0.269 1.00 0.00 C ATOM 366 CG LEU A 23 -11.766 0.368 0.621 1.00 0.00 C ATOM 367 CD1 LEU A 23 -12.444 -0.194 -0.623 1.00 0.00 C ATOM 368 CD2 LEU A 23 -11.577 -0.711 1.675 1.00 0.00 C ATOM 0 H LEU A 23 -8.192 -0.338 1.072 1.00 0.00 H new ATOM 0 HA LEU A 23 -10.050 -0.508 -1.219 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -9.926 1.293 1.194 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -10.608 1.912 -0.297 1.00 0.00 H new ATOM 0 HG LEU A 23 -12.417 1.140 1.032 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -13.400 -0.639 -0.347 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -12.611 0.609 -1.340 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -11.806 -0.955 -1.073 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -12.542 -1.155 1.919 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -10.910 -1.482 1.290 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -11.143 -0.271 2.573 1.00 0.00 H new ATOM 380 N ILE A 24 -8.827 1.157 -2.608 1.00 0.00 N ATOM 381 CA ILE A 24 -8.025 1.996 -3.481 1.00 0.00 C ATOM 382 C ILE A 24 -8.885 3.142 -4.013 1.00 0.00 C ATOM 383 O ILE A 24 -9.752 2.932 -4.859 1.00 0.00 O ATOM 384 CB ILE A 24 -7.449 1.180 -4.661 1.00 0.00 C ATOM 385 CG1 ILE A 24 -6.385 0.194 -4.163 1.00 0.00 C ATOM 386 CG2 ILE A 24 -6.876 2.099 -5.730 1.00 0.00 C ATOM 387 CD1 ILE A 24 -5.063 0.845 -3.804 1.00 0.00 C ATOM 0 H ILE A 24 -9.624 0.714 -3.065 1.00 0.00 H new ATOM 0 HA ILE A 24 -7.190 2.396 -2.907 1.00 0.00 H new ATOM 0 HB ILE A 24 -8.262 0.610 -5.110 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -6.770 -0.330 -3.288 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -6.211 -0.557 -4.933 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -6.477 1.500 -6.549 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -7.662 2.752 -6.108 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -6.077 2.703 -5.300 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -4.363 0.083 -3.461 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -4.653 1.345 -4.682 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -5.221 1.576 -3.011 1.00 0.00 H new ATOM 399 N THR A 25 -8.655 4.347 -3.501 1.00 0.00 N ATOM 400 CA THR A 25 -9.434 5.507 -3.925 1.00 0.00 C ATOM 401 C THR A 25 -8.550 6.719 -4.202 1.00 0.00 C ATOM 402 O THR A 25 -7.383 6.757 -3.819 1.00 0.00 O ATOM 403 CB THR A 25 -10.477 5.858 -2.863 1.00 0.00 C ATOM 404 OG1 THR A 25 -10.764 4.735 -2.049 1.00 0.00 O ATOM 405 CG2 THR A 25 -11.785 6.345 -3.450 1.00 0.00 C ATOM 0 H THR A 25 -7.943 4.546 -2.798 1.00 0.00 H new ATOM 0 HA THR A 25 -9.934 5.241 -4.856 1.00 0.00 H new ATOM 0 HB THR A 25 -10.034 6.665 -2.279 1.00 0.00 H new ATOM 0 HG1 THR A 25 -11.432 4.981 -1.375 1.00 0.00 H new ATOM 0 HG21 THR A 25 -12.481 6.577 -2.644 1.00 0.00 H new ATOM 0 HG22 THR A 25 -11.606 7.241 -4.044 1.00 0.00 H new ATOM 0 HG23 THR A 25 -12.211 5.568 -4.085 1.00 0.00 H new ATOM 413 N HIS A 26 -9.134 7.704 -4.873 1.00 0.00 N ATOM 414 CA HIS A 26 -8.438 8.936 -5.230 1.00 0.00 C ATOM 415 C HIS A 26 -8.405 9.915 -4.064 1.00 0.00 C ATOM 416 O HIS A 26 -9.282 9.904 -3.203 1.00 0.00 O ATOM 417 CB HIS A 26 -9.096 9.590 -6.449 1.00 0.00 C ATOM 418 CG HIS A 26 -10.547 9.901 -6.259 1.00 0.00 C ATOM 419 ND1 HIS A 26 -11.541 8.950 -6.348 1.00 0.00 N ATOM 420 CD2 HIS A 26 -11.175 11.070 -5.987 1.00 0.00 C ATOM 421 CE1 HIS A 26 -12.716 9.517 -6.143 1.00 0.00 C ATOM 422 NE2 HIS A 26 -12.522 10.804 -5.920 1.00 0.00 N ATOM 0 H HIS A 26 -10.104 7.672 -5.186 1.00 0.00 H new ATOM 0 HA HIS A 26 -7.410 8.674 -5.479 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -8.565 10.512 -6.686 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -8.985 8.928 -7.308 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -10.705 12.032 -5.848 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -13.672 9.014 -6.156 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -13.253 11.489 -5.729 1.00 0.00 H new ATOM 430 N ASN A 27 -7.378 10.759 -4.038 1.00 0.00 N ATOM 431 CA ASN A 27 -7.225 11.740 -2.973 1.00 0.00 C ATOM 432 C ASN A 27 -8.398 12.713 -2.999 1.00 0.00 C ATOM 433 O ASN A 27 -9.047 12.883 -4.031 1.00 0.00 O ATOM 434 CB ASN A 27 -5.906 12.501 -3.130 1.00 0.00 C ATOM 435 CG ASN A 27 -5.738 13.088 -4.517 1.00 0.00 C ATOM 436 OD1 ASN A 27 -5.646 12.361 -5.506 1.00 0.00 O ATOM 437 ND2 ASN A 27 -5.698 14.413 -4.598 1.00 0.00 N ATOM 0 H ASN A 27 -6.641 10.782 -4.742 1.00 0.00 H new ATOM 0 HA ASN A 27 -7.210 11.220 -2.015 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -5.862 13.302 -2.392 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -5.075 11.828 -2.920 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -5.587 14.865 -5.505 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -5.778 14.978 -3.753 1.00 0.00 H new ATOM 444 N PRO A 28 -8.718 13.331 -1.852 1.00 0.00 N ATOM 445 CA PRO A 28 -9.856 14.243 -1.750 1.00 0.00 C ATOM 446 C PRO A 28 -9.815 15.367 -2.772 1.00 0.00 C ATOM 447 O PRO A 28 -8.760 15.931 -3.058 1.00 0.00 O ATOM 448 CB PRO A 28 -9.750 14.802 -0.331 1.00 0.00 C ATOM 449 CG PRO A 28 -8.974 13.780 0.427 1.00 0.00 C ATOM 450 CD PRO A 28 -8.026 13.162 -0.562 1.00 0.00 C ATOM 0 HA PRO A 28 -10.795 13.726 -1.950 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -9.244 15.768 -0.324 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -10.736 14.955 0.108 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -8.431 14.237 1.255 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -9.635 13.027 0.856 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -7.058 13.663 -0.557 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -7.842 12.111 -0.339 1.00 0.00 H new ATOM 458 N THR A 29 -10.985 15.681 -3.318 1.00 0.00 N ATOM 459 CA THR A 29 -11.117 16.734 -4.310 1.00 0.00 C ATOM 460 C THR A 29 -11.604 18.015 -3.651 1.00 0.00 C ATOM 461 O THR A 29 -11.909 18.029 -2.463 1.00 0.00 O ATOM 462 CB THR A 29 -12.086 16.311 -5.416 1.00 0.00 C ATOM 463 OG1 THR A 29 -12.036 14.909 -5.616 1.00 0.00 O ATOM 464 CG2 THR A 29 -11.802 16.974 -6.746 1.00 0.00 C ATOM 0 H THR A 29 -11.862 15.214 -3.085 1.00 0.00 H new ATOM 0 HA THR A 29 -10.139 16.914 -4.756 1.00 0.00 H new ATOM 0 HB THR A 29 -13.071 16.627 -5.074 1.00 0.00 H new ATOM 0 HG1 THR A 29 -12.663 14.657 -6.326 1.00 0.00 H new ATOM 0 HG21 THR A 29 -12.525 16.630 -7.486 1.00 0.00 H new ATOM 0 HG22 THR A 29 -11.880 18.056 -6.637 1.00 0.00 H new ATOM 0 HG23 THR A 29 -10.796 16.714 -7.075 1.00 0.00 H new ATOM 472 N ASN A 30 -11.659 19.094 -4.418 1.00 0.00 N ATOM 473 CA ASN A 30 -12.094 20.376 -3.883 1.00 0.00 C ATOM 474 C ASN A 30 -13.588 20.616 -4.094 1.00 0.00 C ATOM 475 O ASN A 30 -14.145 21.566 -3.546 1.00 0.00 O ATOM 476 CB ASN A 30 -11.294 21.510 -4.525 1.00 0.00 C ATOM 477 CG ASN A 30 -11.258 22.755 -3.658 1.00 0.00 C ATOM 478 OD1 ASN A 30 -12.011 23.702 -3.880 1.00 0.00 O ATOM 479 ND2 ASN A 30 -10.376 22.757 -2.664 1.00 0.00 N ATOM 0 H ASN A 30 -11.410 19.108 -5.407 1.00 0.00 H new ATOM 0 HA ASN A 30 -11.913 20.355 -2.808 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -10.275 21.171 -4.712 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -11.731 21.757 -5.493 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -10.304 23.567 -2.048 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -9.771 21.949 -2.517 1.00 0.00 H new ATOM 486 N ALA A 31 -14.241 19.777 -4.900 1.00 0.00 N ATOM 487 CA ALA A 31 -15.664 19.964 -5.161 1.00 0.00 C ATOM 488 C ALA A 31 -16.556 19.152 -4.220 1.00 0.00 C ATOM 489 O ALA A 31 -17.665 19.582 -3.900 1.00 0.00 O ATOM 490 CB ALA A 31 -15.977 19.611 -6.607 1.00 0.00 C ATOM 0 H ALA A 31 -13.817 18.979 -5.373 1.00 0.00 H new ATOM 0 HA ALA A 31 -15.884 21.015 -4.976 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -17.041 19.753 -6.794 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -15.402 20.256 -7.272 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -15.712 18.570 -6.793 1.00 0.00 H new ATOM 496 N THR A 32 -16.088 17.990 -3.764 1.00 0.00 N ATOM 497 CA THR A 32 -16.893 17.176 -2.851 1.00 0.00 C ATOM 498 C THR A 32 -16.055 16.547 -1.739 1.00 0.00 C ATOM 499 O THR A 32 -15.575 15.423 -1.878 1.00 0.00 O ATOM 500 CB THR A 32 -17.617 16.078 -3.631 1.00 0.00 C ATOM 501 OG1 THR A 32 -16.688 15.205 -4.249 1.00 0.00 O ATOM 502 CG2 THR A 32 -18.532 16.615 -4.711 1.00 0.00 C ATOM 0 H THR A 32 -15.178 17.597 -4.004 1.00 0.00 H new ATOM 0 HA THR A 32 -17.617 17.841 -2.381 1.00 0.00 H new ATOM 0 HB THR A 32 -18.222 15.551 -2.893 1.00 0.00 H new ATOM 0 HG1 THR A 32 -15.965 14.999 -3.621 1.00 0.00 H new ATOM 0 HG21 THR A 32 -19.014 15.784 -5.226 1.00 0.00 H new ATOM 0 HG22 THR A 32 -19.292 17.253 -4.260 1.00 0.00 H new ATOM 0 HG23 THR A 32 -17.949 17.196 -5.426 1.00 0.00 H new ATOM 510 N LEU A 33 -15.911 17.254 -0.623 1.00 0.00 N ATOM 511 CA LEU A 33 -15.164 16.727 0.514 1.00 0.00 C ATOM 512 C LEU A 33 -16.016 15.757 1.335 1.00 0.00 C ATOM 513 O LEU A 33 -15.598 14.637 1.630 1.00 0.00 O ATOM 514 CB LEU A 33 -14.644 17.861 1.400 1.00 0.00 C ATOM 515 CG LEU A 33 -13.119 17.959 1.478 1.00 0.00 C ATOM 516 CD1 LEU A 33 -12.531 16.703 2.103 1.00 0.00 C ATOM 517 CD2 LEU A 33 -12.532 18.177 0.094 1.00 0.00 C ATOM 0 H LEU A 33 -16.299 18.187 -0.481 1.00 0.00 H new ATOM 0 HA LEU A 33 -14.309 16.178 0.120 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -15.037 18.806 1.026 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -15.039 17.728 2.407 1.00 0.00 H new ATOM 0 HG LEU A 33 -12.864 18.811 2.108 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -11.446 16.793 2.149 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -12.928 16.578 3.110 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -12.798 15.836 1.498 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -11.446 18.245 0.166 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -12.802 17.341 -0.551 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -12.926 19.102 -0.327 1.00 0.00 H new ATOM 529 N SER A 34 -17.205 16.218 1.717 1.00 0.00 N ATOM 530 CA SER A 34 -18.131 15.429 2.528 1.00 0.00 C ATOM 531 C SER A 34 -18.492 14.101 1.869 1.00 0.00 C ATOM 532 O SER A 34 -18.501 13.056 2.519 1.00 0.00 O ATOM 533 CB SER A 34 -19.406 16.231 2.796 1.00 0.00 C ATOM 534 OG SER A 34 -19.780 16.989 1.657 1.00 0.00 O ATOM 0 H SER A 34 -17.553 17.146 1.474 1.00 0.00 H new ATOM 0 HA SER A 34 -17.626 15.205 3.467 1.00 0.00 H new ATOM 0 HB2 SER A 34 -20.215 15.553 3.068 1.00 0.00 H new ATOM 0 HB3 SER A 34 -19.249 16.897 3.645 1.00 0.00 H new ATOM 0 HG SER A 34 -20.598 17.491 1.853 1.00 0.00 H new ATOM 540 N THR A 35 -18.805 14.139 0.582 1.00 0.00 N ATOM 541 CA THR A 35 -19.180 12.930 -0.141 1.00 0.00 C ATOM 542 C THR A 35 -18.077 11.878 -0.066 1.00 0.00 C ATOM 543 O THR A 35 -18.349 10.674 -0.074 1.00 0.00 O ATOM 544 CB THR A 35 -19.486 13.260 -1.603 1.00 0.00 C ATOM 545 OG1 THR A 35 -20.267 14.438 -1.698 1.00 0.00 O ATOM 546 CG2 THR A 35 -20.229 12.157 -2.323 1.00 0.00 C ATOM 0 H THR A 35 -18.807 14.989 0.018 1.00 0.00 H new ATOM 0 HA THR A 35 -20.074 12.522 0.330 1.00 0.00 H new ATOM 0 HB THR A 35 -18.514 13.391 -2.079 1.00 0.00 H new ATOM 0 HG1 THR A 35 -20.451 14.633 -2.641 1.00 0.00 H new ATOM 0 HG21 THR A 35 -20.414 12.456 -3.355 1.00 0.00 H new ATOM 0 HG22 THR A 35 -19.630 11.247 -2.311 1.00 0.00 H new ATOM 0 HG23 THR A 35 -21.180 11.972 -1.823 1.00 0.00 H new ATOM 554 N PHE A 36 -16.831 12.334 -0.006 1.00 0.00 N ATOM 555 CA PHE A 36 -15.696 11.425 0.050 1.00 0.00 C ATOM 556 C PHE A 36 -15.535 10.788 1.427 1.00 0.00 C ATOM 557 O PHE A 36 -15.363 9.576 1.535 1.00 0.00 O ATOM 558 CB PHE A 36 -14.410 12.162 -0.325 1.00 0.00 C ATOM 559 CG PHE A 36 -13.566 11.445 -1.341 1.00 0.00 C ATOM 560 CD1 PHE A 36 -13.726 10.088 -1.589 1.00 0.00 C ATOM 561 CD2 PHE A 36 -12.602 12.137 -2.045 1.00 0.00 C ATOM 562 CE1 PHE A 36 -12.940 9.442 -2.521 1.00 0.00 C ATOM 563 CE2 PHE A 36 -11.811 11.497 -2.978 1.00 0.00 C ATOM 564 CZ PHE A 36 -11.980 10.147 -3.216 1.00 0.00 C ATOM 0 H PHE A 36 -16.583 13.323 0.005 1.00 0.00 H new ATOM 0 HA PHE A 36 -15.889 10.627 -0.667 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -14.669 13.147 -0.713 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -13.818 12.320 0.577 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -14.475 9.531 -1.046 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -12.465 13.193 -1.864 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -13.076 8.387 -2.706 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -11.060 12.052 -3.522 1.00 0.00 H new ATOM 0 HZ PHE A 36 -11.362 9.645 -3.945 1.00 0.00 H new ATOM 574 N ILE A 37 -15.588 11.596 2.479 1.00 0.00 N ATOM 575 CA ILE A 37 -15.441 11.074 3.829 1.00 0.00 C ATOM 576 C ILE A 37 -16.463 9.980 4.094 1.00 0.00 C ATOM 577 O ILE A 37 -16.168 8.975 4.739 1.00 0.00 O ATOM 578 CB ILE A 37 -15.597 12.173 4.894 1.00 0.00 C ATOM 579 CG1 ILE A 37 -16.799 13.068 4.592 1.00 0.00 C ATOM 580 CG2 ILE A 37 -14.325 13.001 4.999 1.00 0.00 C ATOM 581 CD1 ILE A 37 -17.148 14.011 5.723 1.00 0.00 C ATOM 0 H ILE A 37 -15.730 12.605 2.424 1.00 0.00 H new ATOM 0 HA ILE A 37 -14.433 10.666 3.900 1.00 0.00 H new ATOM 0 HB ILE A 37 -15.774 11.687 5.854 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -16.592 13.651 3.694 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -17.663 12.441 4.373 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -14.455 13.773 5.757 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -13.492 12.355 5.278 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -14.115 13.469 4.037 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -18.010 14.615 5.440 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -17.387 13.435 6.617 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -16.299 14.663 5.928 1.00 0.00 H new ATOM 593 N GLU A 38 -17.666 10.189 3.583 1.00 0.00 N ATOM 594 CA GLU A 38 -18.748 9.230 3.750 1.00 0.00 C ATOM 595 C GLU A 38 -18.453 7.920 3.019 1.00 0.00 C ATOM 596 O GLU A 38 -18.557 6.844 3.604 1.00 0.00 O ATOM 597 CB GLU A 38 -20.064 9.825 3.244 1.00 0.00 C ATOM 598 CG GLU A 38 -20.956 10.361 4.352 1.00 0.00 C ATOM 599 CD GLU A 38 -21.817 11.523 3.898 1.00 0.00 C ATOM 600 OE1 GLU A 38 -22.129 11.593 2.691 1.00 0.00 O ATOM 601 OE2 GLU A 38 -22.179 12.362 4.750 1.00 0.00 O ATOM 0 H GLU A 38 -17.919 11.019 3.046 1.00 0.00 H new ATOM 0 HA GLU A 38 -18.836 9.010 4.814 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -19.843 10.631 2.545 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -20.608 9.061 2.688 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -21.598 9.559 4.716 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -20.336 10.679 5.190 1.00 0.00 H new ATOM 608 N ASP A 39 -18.100 8.012 1.735 1.00 0.00 N ATOM 609 CA ASP A 39 -17.814 6.816 0.938 1.00 0.00 C ATOM 610 C ASP A 39 -16.533 6.113 1.398 1.00 0.00 C ATOM 611 O ASP A 39 -16.525 4.897 1.634 1.00 0.00 O ATOM 612 CB ASP A 39 -17.693 7.191 -0.541 1.00 0.00 C ATOM 613 CG ASP A 39 -19.010 7.063 -1.279 1.00 0.00 C ATOM 614 OD1 ASP A 39 -19.954 7.809 -0.941 1.00 0.00 O ATOM 615 OD2 ASP A 39 -19.099 6.219 -2.195 1.00 0.00 O ATOM 0 H ASP A 39 -18.006 8.892 1.229 1.00 0.00 H new ATOM 0 HA ASP A 39 -18.643 6.123 1.079 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -17.331 8.216 -0.625 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -16.950 6.550 -1.016 1.00 0.00 H new ATOM 620 N LEU A 40 -15.453 6.880 1.530 1.00 0.00 N ATOM 621 CA LEU A 40 -14.171 6.328 1.962 1.00 0.00 C ATOM 622 C LEU A 40 -14.323 5.608 3.295 1.00 0.00 C ATOM 623 O LEU A 40 -13.836 4.491 3.468 1.00 0.00 O ATOM 624 CB LEU A 40 -13.118 7.436 2.072 1.00 0.00 C ATOM 625 CG LEU A 40 -12.854 8.213 0.779 1.00 0.00 C ATOM 626 CD1 LEU A 40 -11.869 9.347 1.021 1.00 0.00 C ATOM 627 CD2 LEU A 40 -12.335 7.285 -0.308 1.00 0.00 C ATOM 0 H LEU A 40 -15.440 7.883 1.345 1.00 0.00 H new ATOM 0 HA LEU A 40 -13.838 5.608 1.215 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -13.433 8.140 2.842 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -12.181 6.993 2.409 1.00 0.00 H new ATOM 0 HG LEU A 40 -13.798 8.644 0.445 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -11.697 9.885 0.089 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -12.278 10.031 1.764 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -10.926 8.938 1.384 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -12.154 7.856 -1.218 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -11.404 6.823 0.022 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -13.074 6.509 -0.508 1.00 0.00 H new ATOM 639 N LYS A 41 -15.021 6.246 4.225 1.00 0.00 N ATOM 640 CA LYS A 41 -15.259 5.657 5.533 1.00 0.00 C ATOM 641 C LYS A 41 -16.368 4.614 5.442 1.00 0.00 C ATOM 642 O LYS A 41 -16.422 3.676 6.237 1.00 0.00 O ATOM 643 CB LYS A 41 -15.637 6.740 6.547 1.00 0.00 C ATOM 644 CG LYS A 41 -15.193 6.423 7.967 1.00 0.00 C ATOM 645 CD LYS A 41 -16.381 6.215 8.892 1.00 0.00 C ATOM 646 CE LYS A 41 -15.935 5.992 10.328 1.00 0.00 C ATOM 647 NZ LYS A 41 -15.466 7.254 10.965 1.00 0.00 N ATOM 0 H LYS A 41 -15.432 7.171 4.097 1.00 0.00 H new ATOM 0 HA LYS A 41 -14.342 5.172 5.869 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -15.193 7.686 6.239 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -16.718 6.877 6.535 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -14.573 5.527 7.963 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -14.575 7.237 8.346 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -17.037 7.084 8.844 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -16.962 5.357 8.553 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -16.762 5.579 10.905 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -15.133 5.255 10.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -15.332 7.099 11.985 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -14.564 7.544 10.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -16.175 8.001 10.819 1.00 0.00 H new ATOM 661 N LYS A 42 -17.254 4.790 4.461 1.00 0.00 N ATOM 662 CA LYS A 42 -18.367 3.873 4.255 1.00 0.00 C ATOM 663 C LYS A 42 -17.887 2.430 4.161 1.00 0.00 C ATOM 664 O LYS A 42 -18.486 1.535 4.760 1.00 0.00 O ATOM 665 CB LYS A 42 -19.141 4.244 2.990 1.00 0.00 C ATOM 666 CG LYS A 42 -20.530 4.798 3.266 1.00 0.00 C ATOM 667 CD LYS A 42 -21.253 5.157 1.978 1.00 0.00 C ATOM 668 CE LYS A 42 -22.337 6.195 2.218 1.00 0.00 C ATOM 669 NZ LYS A 42 -22.720 6.898 0.963 1.00 0.00 N ATOM 0 H LYS A 42 -17.219 5.563 3.796 1.00 0.00 H new ATOM 0 HA LYS A 42 -19.028 3.959 5.118 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -18.569 4.983 2.428 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -19.230 3.361 2.357 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -21.113 4.062 3.819 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -20.451 5.682 3.899 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -20.536 5.540 1.252 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -21.696 4.260 1.546 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -23.215 5.711 2.645 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -21.987 6.923 2.950 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -23.461 7.597 1.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -21.888 7.381 0.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -23.078 6.207 0.273 1.00 0.00 H new ATOM 683 N TYR A 43 -16.813 2.192 3.408 1.00 0.00 N ATOM 684 CA TYR A 43 -16.302 0.834 3.268 1.00 0.00 C ATOM 685 C TYR A 43 -15.826 0.297 4.613 1.00 0.00 C ATOM 686 O TYR A 43 -16.028 -0.877 4.926 1.00 0.00 O ATOM 687 CB TYR A 43 -15.161 0.778 2.259 1.00 0.00 C ATOM 688 CG TYR A 43 -14.821 -0.631 1.832 1.00 0.00 C ATOM 689 CD1 TYR A 43 -14.181 -1.498 2.705 1.00 0.00 C ATOM 690 CD2 TYR A 43 -15.141 -1.096 0.564 1.00 0.00 C ATOM 691 CE1 TYR A 43 -13.866 -2.789 2.330 1.00 0.00 C ATOM 692 CE2 TYR A 43 -14.830 -2.387 0.178 1.00 0.00 C ATOM 693 CZ TYR A 43 -14.192 -3.229 1.065 1.00 0.00 C ATOM 694 OH TYR A 43 -13.881 -4.514 0.685 1.00 0.00 O ATOM 0 H TYR A 43 -16.292 2.905 2.898 1.00 0.00 H new ATOM 0 HA TYR A 43 -17.119 0.210 2.904 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -15.431 1.363 1.380 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -14.276 1.244 2.693 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -13.924 -1.157 3.697 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -15.641 -0.439 -0.132 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -13.367 -3.450 3.023 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -15.085 -2.734 -0.812 1.00 0.00 H new ATOM 0 HH TYR A 43 -13.705 -4.537 -0.279 1.00 0.00 H new ATOM 704 N GLY A 44 -15.204 1.160 5.410 1.00 0.00 N ATOM 705 CA GLY A 44 -14.728 0.739 6.715 1.00 0.00 C ATOM 706 C GLY A 44 -13.710 1.690 7.306 1.00 0.00 C ATOM 707 O GLY A 44 -13.410 2.730 6.719 1.00 0.00 O ATOM 0 H GLY A 44 -15.022 2.136 5.178 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -15.576 0.654 7.395 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -14.285 -0.253 6.632 1.00 0.00 H new ATOM 711 N ALA A 45 -13.201 1.354 8.490 1.00 0.00 N ATOM 712 CA ALA A 45 -12.241 2.221 9.164 1.00 0.00 C ATOM 713 C ALA A 45 -10.980 1.507 9.659 1.00 0.00 C ATOM 714 O ALA A 45 -11.035 0.646 10.537 1.00 0.00 O ATOM 715 CB ALA A 45 -12.931 2.903 10.320 1.00 0.00 C ATOM 0 H ALA A 45 -13.434 0.499 8.995 1.00 0.00 H new ATOM 0 HA ALA A 45 -11.896 2.941 8.422 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -12.224 3.555 10.833 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -13.766 3.496 9.947 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -13.303 2.151 11.017 1.00 0.00 H new ATOM 721 N THR A 46 -9.844 1.921 9.109 1.00 0.00 N ATOM 722 CA THR A 46 -8.530 1.400 9.488 1.00 0.00 C ATOM 723 C THR A 46 -7.456 2.337 8.951 1.00 0.00 C ATOM 724 O THR A 46 -7.770 3.434 8.490 1.00 0.00 O ATOM 725 CB THR A 46 -8.309 -0.041 9.030 1.00 0.00 C ATOM 726 OG1 THR A 46 -9.526 -0.760 9.071 1.00 0.00 O ATOM 727 CG2 THR A 46 -7.317 -0.795 9.891 1.00 0.00 C ATOM 0 H THR A 46 -9.806 2.634 8.381 1.00 0.00 H new ATOM 0 HA THR A 46 -8.473 1.366 10.576 1.00 0.00 H new ATOM 0 HB THR A 46 -7.913 0.030 8.017 1.00 0.00 H new ATOM 0 HG1 THR A 46 -10.020 -0.520 9.883 1.00 0.00 H new ATOM 0 HG21 THR A 46 -7.205 -1.811 9.513 1.00 0.00 H new ATOM 0 HG22 THR A 46 -6.352 -0.289 9.862 1.00 0.00 H new ATOM 0 HG23 THR A 46 -7.679 -0.828 10.919 1.00 0.00 H new ATOM 735 N THR A 47 -6.195 1.931 9.016 1.00 0.00 N ATOM 736 CA THR A 47 -5.123 2.785 8.535 1.00 0.00 C ATOM 737 C THR A 47 -5.250 3.004 7.028 1.00 0.00 C ATOM 738 O THR A 47 -5.937 2.255 6.325 1.00 0.00 O ATOM 739 CB THR A 47 -3.763 2.164 8.859 1.00 0.00 C ATOM 740 OG1 THR A 47 -2.720 2.886 8.226 1.00 0.00 O ATOM 741 CG2 THR A 47 -3.648 0.718 8.428 1.00 0.00 C ATOM 0 H THR A 47 -5.895 1.031 9.391 1.00 0.00 H new ATOM 0 HA THR A 47 -5.200 3.749 9.037 1.00 0.00 H new ATOM 0 HB THR A 47 -3.674 2.210 9.944 1.00 0.00 H new ATOM 0 HG1 THR A 47 -1.977 2.279 8.026 1.00 0.00 H new ATOM 0 HG21 THR A 47 -2.660 0.339 8.687 1.00 0.00 H new ATOM 0 HG22 THR A 47 -4.409 0.125 8.936 1.00 0.00 H new ATOM 0 HG23 THR A 47 -3.793 0.647 7.350 1.00 0.00 H new ATOM 749 N VAL A 48 -4.617 4.064 6.547 1.00 0.00 N ATOM 750 CA VAL A 48 -4.683 4.416 5.138 1.00 0.00 C ATOM 751 C VAL A 48 -3.324 4.860 4.614 1.00 0.00 C ATOM 752 O VAL A 48 -2.605 5.596 5.285 1.00 0.00 O ATOM 753 CB VAL A 48 -5.700 5.556 4.917 1.00 0.00 C ATOM 754 CG1 VAL A 48 -5.800 5.935 3.445 1.00 0.00 C ATOM 755 CG2 VAL A 48 -7.061 5.167 5.470 1.00 0.00 C ATOM 0 H VAL A 48 -4.051 4.696 7.114 1.00 0.00 H new ATOM 0 HA VAL A 48 -4.998 3.526 4.594 1.00 0.00 H new ATOM 0 HB VAL A 48 -5.344 6.433 5.457 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -6.525 6.740 3.325 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -4.825 6.268 3.088 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -6.122 5.069 2.867 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -7.767 5.982 5.306 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -7.417 4.271 4.962 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -6.977 4.969 6.539 1.00 0.00 H new ATOM 765 N VAL A 49 -2.981 4.425 3.407 1.00 0.00 N ATOM 766 CA VAL A 49 -1.714 4.814 2.806 1.00 0.00 C ATOM 767 C VAL A 49 -1.943 5.650 1.554 1.00 0.00 C ATOM 768 O VAL A 49 -2.302 5.130 0.493 1.00 0.00 O ATOM 769 CB VAL A 49 -0.845 3.592 2.455 1.00 0.00 C ATOM 770 CG1 VAL A 49 -1.529 2.709 1.425 1.00 0.00 C ATOM 771 CG2 VAL A 49 0.523 4.033 1.963 1.00 0.00 C ATOM 0 H VAL A 49 -3.556 3.810 2.832 1.00 0.00 H new ATOM 0 HA VAL A 49 -1.182 5.410 3.548 1.00 0.00 H new ATOM 0 HB VAL A 49 -0.711 3.003 3.362 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -0.891 1.855 1.197 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -2.480 2.356 1.823 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -1.706 3.282 0.515 1.00 0.00 H new ATOM 0 HG21 VAL A 49 1.122 3.156 1.720 1.00 0.00 H new ATOM 0 HG22 VAL A 49 0.408 4.651 1.073 1.00 0.00 H new ATOM 0 HG23 VAL A 49 1.022 4.609 2.743 1.00 0.00 H new ATOM 781 N ARG A 50 -1.723 6.950 1.676 1.00 0.00 N ATOM 782 CA ARG A 50 -1.889 7.843 0.547 1.00 0.00 C ATOM 783 C ARG A 50 -0.554 8.447 0.152 1.00 0.00 C ATOM 784 O ARG A 50 -0.008 9.280 0.878 1.00 0.00 O ATOM 785 CB ARG A 50 -2.887 8.953 0.887 1.00 0.00 C ATOM 786 CG ARG A 50 -2.643 9.594 2.242 1.00 0.00 C ATOM 787 CD ARG A 50 -3.142 11.030 2.276 1.00 0.00 C ATOM 788 NE ARG A 50 -4.568 11.107 2.586 1.00 0.00 N ATOM 789 CZ ARG A 50 -5.324 12.174 2.339 1.00 0.00 C ATOM 790 NH1 ARG A 50 -4.794 13.256 1.781 1.00 0.00 N ATOM 791 NH2 ARG A 50 -6.612 12.160 2.652 1.00 0.00 N ATOM 0 H ARG A 50 -1.431 7.405 2.541 1.00 0.00 H new ATOM 0 HA ARG A 50 -2.277 7.268 -0.294 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -2.839 9.722 0.116 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -3.896 8.542 0.865 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -3.146 9.014 3.016 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -1.577 9.572 2.470 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -2.578 11.592 3.021 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -2.955 11.502 1.311 1.00 0.00 H new ATOM 0 HE ARG A 50 -5.010 10.295 3.017 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -3.803 13.272 1.540 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -5.378 14.071 1.594 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -7.023 11.332 3.082 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -7.192 12.978 2.463 1.00 0.00 H new ATOM 805 N VAL A 51 -0.036 8.058 -1.005 1.00 0.00 N ATOM 806 CA VAL A 51 1.224 8.614 -1.465 1.00 0.00 C ATOM 807 C VAL A 51 0.963 9.570 -2.611 1.00 0.00 C ATOM 808 O VAL A 51 0.934 9.180 -3.778 1.00 0.00 O ATOM 809 CB VAL A 51 2.208 7.522 -1.930 1.00 0.00 C ATOM 810 CG1 VAL A 51 3.611 8.095 -2.079 1.00 0.00 C ATOM 811 CG2 VAL A 51 2.202 6.345 -0.963 1.00 0.00 C ATOM 0 H VAL A 51 -0.461 7.373 -1.630 1.00 0.00 H new ATOM 0 HA VAL A 51 1.680 9.136 -0.624 1.00 0.00 H new ATOM 0 HB VAL A 51 1.883 7.159 -2.905 1.00 0.00 H new ATOM 0 HG11 VAL A 51 4.292 7.310 -2.408 1.00 0.00 H new ATOM 0 HG12 VAL A 51 3.600 8.898 -2.816 1.00 0.00 H new ATOM 0 HG13 VAL A 51 3.947 8.488 -1.120 1.00 0.00 H new ATOM 0 HG21 VAL A 51 2.903 5.586 -1.310 1.00 0.00 H new ATOM 0 HG22 VAL A 51 2.499 6.687 0.028 1.00 0.00 H new ATOM 0 HG23 VAL A 51 1.200 5.919 -0.915 1.00 0.00 H new ATOM 821 N CYS A 52 0.773 10.825 -2.255 1.00 0.00 N ATOM 822 CA CYS A 52 0.511 11.868 -3.222 1.00 0.00 C ATOM 823 C CYS A 52 0.866 13.217 -2.635 1.00 0.00 C ATOM 824 O CYS A 52 1.136 13.330 -1.439 1.00 0.00 O ATOM 825 CB CYS A 52 -0.956 11.848 -3.653 1.00 0.00 C ATOM 826 SG CYS A 52 -2.126 11.727 -2.280 1.00 0.00 S ATOM 0 H CYS A 52 0.796 11.148 -1.288 1.00 0.00 H new ATOM 0 HA CYS A 52 1.129 11.689 -4.102 1.00 0.00 H new ATOM 0 HB2 CYS A 52 -1.170 12.754 -4.220 1.00 0.00 H new ATOM 0 HB3 CYS A 52 -1.114 11.006 -4.327 1.00 0.00 H new ATOM 0 HG CYS A 52 -3.098 10.929 -2.607 1.00 0.00 H new ATOM 832 N GLU A 53 0.844 14.241 -3.464 1.00 0.00 N ATOM 833 CA GLU A 53 1.144 15.578 -2.995 1.00 0.00 C ATOM 834 C GLU A 53 0.046 16.017 -2.032 1.00 0.00 C ATOM 835 O GLU A 53 -1.141 15.860 -2.316 1.00 0.00 O ATOM 836 CB GLU A 53 1.278 16.538 -4.177 1.00 0.00 C ATOM 837 CG GLU A 53 1.866 15.893 -5.434 1.00 0.00 C ATOM 838 CD GLU A 53 2.926 14.833 -5.140 1.00 0.00 C ATOM 839 OE1 GLU A 53 3.989 15.196 -4.596 1.00 0.00 O ATOM 840 OE2 GLU A 53 2.690 13.637 -5.458 1.00 0.00 O ATOM 0 H GLU A 53 0.623 14.174 -4.458 1.00 0.00 H new ATOM 0 HA GLU A 53 2.097 15.586 -2.466 1.00 0.00 H new ATOM 0 HB2 GLU A 53 0.295 16.946 -4.415 1.00 0.00 H new ATOM 0 HB3 GLU A 53 1.908 17.377 -3.882 1.00 0.00 H new ATOM 0 HG2 GLU A 53 1.060 15.438 -6.010 1.00 0.00 H new ATOM 0 HG3 GLU A 53 2.305 16.670 -6.059 1.00 0.00 H new ATOM 847 N VAL A 54 0.451 16.513 -0.873 1.00 0.00 N ATOM 848 CA VAL A 54 -0.498 16.916 0.164 1.00 0.00 C ATOM 849 C VAL A 54 -1.184 18.244 -0.134 1.00 0.00 C ATOM 850 O VAL A 54 -0.530 19.276 -0.283 1.00 0.00 O ATOM 851 CB VAL A 54 0.192 17.016 1.536 1.00 0.00 C ATOM 852 CG1 VAL A 54 0.518 15.631 2.072 1.00 0.00 C ATOM 853 CG2 VAL A 54 1.448 17.870 1.441 1.00 0.00 C ATOM 0 H VAL A 54 1.431 16.648 -0.623 1.00 0.00 H new ATOM 0 HA VAL A 54 -1.261 16.137 0.180 1.00 0.00 H new ATOM 0 HB VAL A 54 -0.494 17.497 2.233 1.00 0.00 H new ATOM 0 HG11 VAL A 54 1.005 15.722 3.043 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -0.402 15.057 2.180 1.00 0.00 H new ATOM 0 HG13 VAL A 54 1.185 15.120 1.378 1.00 0.00 H new ATOM 0 HG21 VAL A 54 1.922 17.929 2.420 1.00 0.00 H new ATOM 0 HG22 VAL A 54 2.140 17.421 0.729 1.00 0.00 H new ATOM 0 HG23 VAL A 54 1.182 18.872 1.105 1.00 0.00 H new ATOM 863 N THR A 55 -2.516 18.210 -0.185 1.00 0.00 N ATOM 864 CA THR A 55 -3.304 19.412 -0.424 1.00 0.00 C ATOM 865 C THR A 55 -4.250 19.673 0.750 1.00 0.00 C ATOM 866 O THR A 55 -4.326 20.790 1.263 1.00 0.00 O ATOM 867 CB THR A 55 -4.105 19.275 -1.720 1.00 0.00 C ATOM 868 OG1 THR A 55 -5.050 18.225 -1.616 1.00 0.00 O ATOM 869 CG2 THR A 55 -3.241 18.996 -2.930 1.00 0.00 C ATOM 0 H THR A 55 -3.069 17.361 -0.064 1.00 0.00 H new ATOM 0 HA THR A 55 -2.622 20.257 -0.519 1.00 0.00 H new ATOM 0 HB THR A 55 -4.597 20.238 -1.859 1.00 0.00 H new ATOM 0 HG1 THR A 55 -5.948 18.602 -1.505 1.00 0.00 H new ATOM 0 HG21 THR A 55 -3.871 18.910 -3.815 1.00 0.00 H new ATOM 0 HG22 THR A 55 -2.532 19.813 -3.067 1.00 0.00 H new ATOM 0 HG23 THR A 55 -2.696 18.064 -2.781 1.00 0.00 H new ATOM 877 N TYR A 56 -4.958 18.626 1.178 1.00 0.00 N ATOM 878 CA TYR A 56 -5.890 18.732 2.302 1.00 0.00 C ATOM 879 C TYR A 56 -5.649 17.611 3.311 1.00 0.00 C ATOM 880 O TYR A 56 -6.319 16.581 3.267 1.00 0.00 O ATOM 881 CB TYR A 56 -7.340 18.674 1.810 1.00 0.00 C ATOM 882 CG TYR A 56 -7.529 19.158 0.390 1.00 0.00 C ATOM 883 CD1 TYR A 56 -7.392 20.503 0.072 1.00 0.00 C ATOM 884 CD2 TYR A 56 -7.845 18.269 -0.632 1.00 0.00 C ATOM 885 CE1 TYR A 56 -7.565 20.951 -1.223 1.00 0.00 C ATOM 886 CE2 TYR A 56 -8.018 18.711 -1.930 1.00 0.00 C ATOM 887 CZ TYR A 56 -7.877 20.052 -2.220 1.00 0.00 C ATOM 888 OH TYR A 56 -8.049 20.494 -3.511 1.00 0.00 O ATOM 0 H TYR A 56 -4.904 17.696 0.763 1.00 0.00 H new ATOM 0 HA TYR A 56 -5.717 19.692 2.789 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -7.696 17.647 1.883 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -7.962 19.275 2.473 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -7.146 21.210 0.850 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -7.957 17.218 -0.408 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -7.456 22.001 -1.453 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -8.263 18.009 -2.714 1.00 0.00 H new ATOM 0 HH TYR A 56 -8.264 19.734 -4.091 1.00 0.00 H new ATOM 898 N ASP A 57 -4.693 17.802 4.211 1.00 0.00 N ATOM 899 CA ASP A 57 -4.386 16.785 5.213 1.00 0.00 C ATOM 900 C ASP A 57 -5.382 16.792 6.376 1.00 0.00 C ATOM 901 O ASP A 57 -5.708 15.743 6.930 1.00 0.00 O ATOM 902 CB ASP A 57 -2.967 16.987 5.748 1.00 0.00 C ATOM 903 CG ASP A 57 -1.937 16.197 4.966 1.00 0.00 C ATOM 904 OD1 ASP A 57 -2.135 16.007 3.747 1.00 0.00 O ATOM 905 OD2 ASP A 57 -0.932 15.769 5.571 1.00 0.00 O ATOM 0 H ASP A 57 -4.120 18.644 4.269 1.00 0.00 H new ATOM 0 HA ASP A 57 -4.464 15.816 4.721 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -2.714 18.047 5.709 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -2.931 16.689 6.796 1.00 0.00 H new ATOM 910 N LYS A 58 -5.835 17.982 6.764 1.00 0.00 N ATOM 911 CA LYS A 58 -6.762 18.127 7.888 1.00 0.00 C ATOM 912 C LYS A 58 -8.215 17.809 7.524 1.00 0.00 C ATOM 913 O LYS A 58 -8.899 17.087 8.249 1.00 0.00 O ATOM 914 CB LYS A 58 -6.679 19.547 8.450 1.00 0.00 C ATOM 915 CG LYS A 58 -5.579 19.729 9.484 1.00 0.00 C ATOM 916 CD LYS A 58 -6.147 19.892 10.886 1.00 0.00 C ATOM 917 CE LYS A 58 -5.435 20.995 11.652 1.00 0.00 C ATOM 918 NZ LYS A 58 -6.379 21.800 12.475 1.00 0.00 N ATOM 0 H LYS A 58 -5.576 18.862 6.317 1.00 0.00 H new ATOM 0 HA LYS A 58 -6.455 17.397 8.637 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -6.513 20.245 7.629 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -7.637 19.807 8.901 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -4.911 18.868 9.460 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -4.981 20.604 9.229 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -7.211 20.119 10.824 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -6.053 18.952 11.429 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -4.675 20.556 12.298 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -4.918 21.649 10.950 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -5.853 22.541 12.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -7.090 22.241 11.857 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -6.854 21.181 13.163 1.00 0.00 H new ATOM 932 N THR A 59 -8.690 18.384 6.425 1.00 0.00 N ATOM 933 CA THR A 59 -10.077 18.199 5.994 1.00 0.00 C ATOM 934 C THR A 59 -10.529 16.736 6.041 1.00 0.00 C ATOM 935 O THR A 59 -11.553 16.423 6.647 1.00 0.00 O ATOM 936 CB THR A 59 -10.276 18.761 4.584 1.00 0.00 C ATOM 937 OG1 THR A 59 -9.209 19.623 4.233 1.00 0.00 O ATOM 938 CG2 THR A 59 -11.564 19.542 4.429 1.00 0.00 C ATOM 0 H THR A 59 -8.137 18.984 5.813 1.00 0.00 H new ATOM 0 HA THR A 59 -10.698 18.748 6.702 1.00 0.00 H new ATOM 0 HB THR A 59 -10.314 17.891 3.928 1.00 0.00 H new ATOM 0 HG1 THR A 59 -9.494 20.218 3.508 1.00 0.00 H new ATOM 0 HG21 THR A 59 -11.644 19.913 3.407 1.00 0.00 H new ATOM 0 HG22 THR A 59 -12.412 18.892 4.647 1.00 0.00 H new ATOM 0 HG23 THR A 59 -11.565 20.384 5.121 1.00 0.00 H new ATOM 946 N PRO A 60 -9.792 15.822 5.387 1.00 0.00 N ATOM 947 CA PRO A 60 -10.150 14.399 5.346 1.00 0.00 C ATOM 948 C PRO A 60 -9.903 13.671 6.666 1.00 0.00 C ATOM 949 O PRO A 60 -10.638 12.751 7.023 1.00 0.00 O ATOM 950 CB PRO A 60 -9.239 13.823 4.249 1.00 0.00 C ATOM 951 CG PRO A 60 -8.596 15.000 3.590 1.00 0.00 C ATOM 952 CD PRO A 60 -8.573 16.090 4.619 1.00 0.00 C ATOM 0 HA PRO A 60 -11.216 14.273 5.155 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -8.489 13.156 4.674 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -9.814 13.239 3.530 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -7.587 14.757 3.257 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -9.158 15.308 2.708 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -7.681 16.041 5.243 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -8.589 17.080 4.163 1.00 0.00 H new ATOM 960 N LEU A 61 -8.853 14.067 7.372 1.00 0.00 N ATOM 961 CA LEU A 61 -8.495 13.430 8.634 1.00 0.00 C ATOM 962 C LEU A 61 -9.476 13.759 9.757 1.00 0.00 C ATOM 963 O LEU A 61 -9.879 12.877 10.516 1.00 0.00 O ATOM 964 CB LEU A 61 -7.085 13.836 9.040 1.00 0.00 C ATOM 965 CG LEU A 61 -6.004 12.836 8.642 1.00 0.00 C ATOM 966 CD1 LEU A 61 -6.002 11.646 9.588 1.00 0.00 C ATOM 967 CD2 LEU A 61 -6.205 12.379 7.204 1.00 0.00 C ATOM 0 H LEU A 61 -8.233 14.827 7.093 1.00 0.00 H new ATOM 0 HA LEU A 61 -8.540 12.353 8.474 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -6.854 14.801 8.590 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -7.056 13.973 10.121 1.00 0.00 H new ATOM 0 HG LEU A 61 -5.035 13.330 8.713 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -5.224 10.944 9.288 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -5.808 11.989 10.604 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -6.972 11.150 9.551 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -5.425 11.666 6.936 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -7.181 11.903 7.106 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -6.153 13.240 6.538 1.00 0.00 H new ATOM 979 N GLU A 62 -9.841 15.029 9.874 1.00 0.00 N ATOM 980 CA GLU A 62 -10.755 15.464 10.925 1.00 0.00 C ATOM 981 C GLU A 62 -12.200 15.068 10.633 1.00 0.00 C ATOM 982 O GLU A 62 -12.993 14.874 11.554 1.00 0.00 O ATOM 983 CB GLU A 62 -10.658 16.981 11.115 1.00 0.00 C ATOM 984 CG GLU A 62 -10.446 17.399 12.561 1.00 0.00 C ATOM 985 CD GLU A 62 -10.913 18.816 12.832 1.00 0.00 C ATOM 986 OE1 GLU A 62 -12.126 19.079 12.696 1.00 0.00 O ATOM 987 OE2 GLU A 62 -10.064 19.664 13.181 1.00 0.00 O ATOM 0 H GLU A 62 -9.520 15.775 9.257 1.00 0.00 H new ATOM 0 HA GLU A 62 -10.455 14.959 11.843 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -9.835 17.363 10.510 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -11.571 17.445 10.741 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -10.982 16.712 13.216 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -9.388 17.315 12.808 1.00 0.00 H new ATOM 994 N LYS A 63 -12.545 14.964 9.357 1.00 0.00 N ATOM 995 CA LYS A 63 -13.904 14.608 8.969 1.00 0.00 C ATOM 996 C LYS A 63 -14.155 13.108 9.093 1.00 0.00 C ATOM 997 O LYS A 63 -15.254 12.687 9.455 1.00 0.00 O ATOM 998 CB LYS A 63 -14.186 15.063 7.536 1.00 0.00 C ATOM 999 CG LYS A 63 -14.828 16.438 7.450 1.00 0.00 C ATOM 1000 CD LYS A 63 -16.228 16.437 8.044 1.00 0.00 C ATOM 1001 CE LYS A 63 -16.911 17.785 7.872 1.00 0.00 C ATOM 1002 NZ LYS A 63 -17.166 18.449 9.181 1.00 0.00 N ATOM 0 H LYS A 63 -11.907 15.120 8.576 1.00 0.00 H new ATOM 0 HA LYS A 63 -14.581 15.120 9.653 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -13.251 15.072 6.976 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -14.839 14.335 7.054 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -14.208 17.164 7.977 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -14.874 16.755 6.408 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -16.826 15.662 7.565 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -16.174 16.189 9.104 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -16.289 18.431 7.252 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -17.855 17.649 7.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -17.632 19.365 9.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -17.780 17.845 9.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -16.263 18.602 9.674 1.00 0.00 H new ATOM 1016 N ASP A 64 -13.147 12.301 8.778 1.00 0.00 N ATOM 1017 CA ASP A 64 -13.295 10.849 8.848 1.00 0.00 C ATOM 1018 C ASP A 64 -12.657 10.263 10.108 1.00 0.00 C ATOM 1019 O ASP A 64 -12.893 9.103 10.445 1.00 0.00 O ATOM 1020 CB ASP A 64 -12.682 10.204 7.603 1.00 0.00 C ATOM 1021 CG ASP A 64 -13.729 9.783 6.587 1.00 0.00 C ATOM 1022 OD1 ASP A 64 -14.929 9.790 6.931 1.00 0.00 O ATOM 1023 OD2 ASP A 64 -13.346 9.444 5.448 1.00 0.00 O ATOM 0 H ASP A 64 -12.228 12.622 8.475 1.00 0.00 H new ATOM 0 HA ASP A 64 -14.362 10.630 8.891 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -11.991 10.907 7.137 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -12.098 9.333 7.900 1.00 0.00 H new ATOM 1028 N GLY A 65 -11.862 11.063 10.810 1.00 0.00 N ATOM 1029 CA GLY A 65 -11.218 10.589 12.024 1.00 0.00 C ATOM 1030 C GLY A 65 -10.499 9.259 11.844 1.00 0.00 C ATOM 1031 O GLY A 65 -10.287 8.529 12.813 1.00 0.00 O ATOM 0 H GLY A 65 -11.651 12.030 10.562 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -10.503 11.338 12.364 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -11.968 10.486 12.808 1.00 0.00 H new ATOM 1035 N ILE A 66 -10.115 8.946 10.608 1.00 0.00 N ATOM 1036 CA ILE A 66 -9.410 7.698 10.315 1.00 0.00 C ATOM 1037 C ILE A 66 -7.901 7.902 10.360 1.00 0.00 C ATOM 1038 O ILE A 66 -7.399 8.968 10.007 1.00 0.00 O ATOM 1039 CB ILE A 66 -9.780 7.139 8.926 1.00 0.00 C ATOM 1040 CG1 ILE A 66 -11.295 7.062 8.757 1.00 0.00 C ATOM 1041 CG2 ILE A 66 -9.156 5.767 8.722 1.00 0.00 C ATOM 1042 CD1 ILE A 66 -11.730 6.962 7.313 1.00 0.00 C ATOM 0 H ILE A 66 -10.279 9.538 9.794 1.00 0.00 H new ATOM 0 HA ILE A 66 -9.717 6.985 11.081 1.00 0.00 H new ATOM 0 HB ILE A 66 -9.386 7.819 8.171 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -11.671 6.197 9.304 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -11.749 7.945 9.206 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -9.427 5.387 7.737 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -8.071 5.846 8.795 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -9.522 5.083 9.488 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -12.818 6.911 7.263 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -11.383 7.839 6.767 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -11.304 6.064 6.866 1.00 0.00 H new ATOM 1054 N THR A 67 -7.176 6.868 10.776 1.00 0.00 N ATOM 1055 CA THR A 67 -5.723 6.940 10.840 1.00 0.00 C ATOM 1056 C THR A 67 -5.142 6.755 9.444 1.00 0.00 C ATOM 1057 O THR A 67 -5.503 5.819 8.734 1.00 0.00 O ATOM 1058 CB THR A 67 -5.175 5.869 11.785 1.00 0.00 C ATOM 1059 OG1 THR A 67 -5.522 4.573 11.331 1.00 0.00 O ATOM 1060 CG2 THR A 67 -5.680 6.008 13.204 1.00 0.00 C ATOM 0 H THR A 67 -7.570 5.975 11.072 1.00 0.00 H new ATOM 0 HA THR A 67 -5.433 7.918 11.225 1.00 0.00 H new ATOM 0 HB THR A 67 -4.094 6.011 11.785 1.00 0.00 H new ATOM 0 HG1 THR A 67 -6.184 4.180 11.938 1.00 0.00 H new ATOM 0 HG21 THR A 67 -5.253 5.218 13.821 1.00 0.00 H new ATOM 0 HG22 THR A 67 -5.384 6.979 13.602 1.00 0.00 H new ATOM 0 HG23 THR A 67 -6.767 5.928 13.213 1.00 0.00 H new ATOM 1068 N VAL A 68 -4.262 7.662 9.040 1.00 0.00 N ATOM 1069 CA VAL A 68 -3.667 7.588 7.712 1.00 0.00 C ATOM 1070 C VAL A 68 -2.220 8.066 7.704 1.00 0.00 C ATOM 1071 O VAL A 68 -1.813 8.882 8.532 1.00 0.00 O ATOM 1072 CB VAL A 68 -4.478 8.428 6.703 1.00 0.00 C ATOM 1073 CG1 VAL A 68 -4.617 9.858 7.197 1.00 0.00 C ATOM 1074 CG2 VAL A 68 -3.839 8.399 5.321 1.00 0.00 C ATOM 0 H VAL A 68 -3.947 8.450 9.606 1.00 0.00 H new ATOM 0 HA VAL A 68 -3.685 6.538 7.420 1.00 0.00 H new ATOM 0 HB VAL A 68 -5.472 7.988 6.620 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -5.191 10.438 6.475 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -5.132 9.863 8.158 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -3.628 10.301 7.313 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -4.433 9.000 4.633 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -2.829 8.805 5.378 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -3.796 7.371 4.961 1.00 0.00 H new ATOM 1084 N VAL A 69 -1.462 7.565 6.738 1.00 0.00 N ATOM 1085 CA VAL A 69 -0.068 7.942 6.571 1.00 0.00 C ATOM 1086 C VAL A 69 0.050 8.907 5.402 1.00 0.00 C ATOM 1087 O VAL A 69 -0.531 8.674 4.339 1.00 0.00 O ATOM 1088 CB VAL A 69 0.836 6.715 6.309 1.00 0.00 C ATOM 1089 CG1 VAL A 69 2.297 7.054 6.567 1.00 0.00 C ATOM 1090 CG2 VAL A 69 0.401 5.532 7.162 1.00 0.00 C ATOM 0 H VAL A 69 -1.796 6.889 6.051 1.00 0.00 H new ATOM 0 HA VAL A 69 0.265 8.412 7.496 1.00 0.00 H new ATOM 0 HB VAL A 69 0.732 6.436 5.260 1.00 0.00 H new ATOM 0 HG11 VAL A 69 2.914 6.176 6.376 1.00 0.00 H new ATOM 0 HG12 VAL A 69 2.605 7.864 5.906 1.00 0.00 H new ATOM 0 HG13 VAL A 69 2.421 7.366 7.604 1.00 0.00 H new ATOM 0 HG21 VAL A 69 1.051 4.680 6.961 1.00 0.00 H new ATOM 0 HG22 VAL A 69 0.469 5.799 8.217 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -0.628 5.268 6.920 1.00 0.00 H new ATOM 1100 N ASP A 70 0.786 9.989 5.594 1.00 0.00 N ATOM 1101 CA ASP A 70 0.947 10.979 4.540 1.00 0.00 C ATOM 1102 C ASP A 70 2.289 10.805 3.851 1.00 0.00 C ATOM 1103 O ASP A 70 3.338 11.123 4.411 1.00 0.00 O ATOM 1104 CB ASP A 70 0.828 12.394 5.110 1.00 0.00 C ATOM 1105 CG ASP A 70 -0.603 12.897 5.114 1.00 0.00 C ATOM 1106 OD1 ASP A 70 -1.355 12.538 6.045 1.00 0.00 O ATOM 1107 OD2 ASP A 70 -0.970 13.648 4.188 1.00 0.00 O ATOM 0 H ASP A 70 1.278 10.204 6.461 1.00 0.00 H new ATOM 0 HA ASP A 70 0.154 10.831 3.807 1.00 0.00 H new ATOM 0 HB2 ASP A 70 1.218 12.407 6.128 1.00 0.00 H new ATOM 0 HB3 ASP A 70 1.447 13.072 4.523 1.00 0.00 H new ATOM 1112 N TRP A 71 2.242 10.284 2.633 1.00 0.00 N ATOM 1113 CA TRP A 71 3.448 10.047 1.859 1.00 0.00 C ATOM 1114 C TRP A 71 3.517 10.980 0.651 1.00 0.00 C ATOM 1115 O TRP A 71 2.812 10.782 -0.336 1.00 0.00 O ATOM 1116 CB TRP A 71 3.448 8.604 1.369 1.00 0.00 C ATOM 1117 CG TRP A 71 4.131 7.633 2.280 1.00 0.00 C ATOM 1118 CD1 TRP A 71 3.897 7.421 3.611 1.00 0.00 C ATOM 1119 CD2 TRP A 71 5.160 6.724 1.903 1.00 0.00 C ATOM 1120 NE1 TRP A 71 4.726 6.429 4.080 1.00 0.00 N ATOM 1121 CE2 TRP A 71 5.511 5.989 3.047 1.00 0.00 C ATOM 1122 CE3 TRP A 71 5.820 6.464 0.702 1.00 0.00 C ATOM 1123 CZ2 TRP A 71 6.491 5.008 3.021 1.00 0.00 C ATOM 1124 CZ3 TRP A 71 6.793 5.491 0.677 1.00 0.00 C ATOM 1125 CH2 TRP A 71 7.120 4.773 1.830 1.00 0.00 C ATOM 0 H TRP A 71 1.378 10.017 2.160 1.00 0.00 H new ATOM 0 HA TRP A 71 4.312 10.237 2.496 1.00 0.00 H new ATOM 0 HB2 TRP A 71 2.416 8.283 1.227 1.00 0.00 H new ATOM 0 HB3 TRP A 71 3.931 8.566 0.393 1.00 0.00 H new ATOM 0 HD1 TRP A 71 3.169 7.954 4.205 1.00 0.00 H new ATOM 0 HE1 TRP A 71 4.752 6.079 5.038 1.00 0.00 H new ATOM 0 HE3 TRP A 71 5.572 7.016 -0.192 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 6.748 4.450 3.909 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 7.311 5.280 -0.247 1.00 0.00 H new ATOM 0 HH2 TRP A 71 7.887 4.015 1.779 1.00 0.00 H new ATOM 1136 N PRO A 72 4.358 12.020 0.710 1.00 0.00 N ATOM 1137 CA PRO A 72 4.508 12.979 -0.364 1.00 0.00 C ATOM 1138 C PRO A 72 5.790 12.770 -1.163 1.00 0.00 C ATOM 1139 O PRO A 72 6.731 12.135 -0.687 1.00 0.00 O ATOM 1140 CB PRO A 72 4.570 14.271 0.430 1.00 0.00 C ATOM 1141 CG PRO A 72 5.302 13.903 1.695 1.00 0.00 C ATOM 1142 CD PRO A 72 5.217 12.393 1.834 1.00 0.00 C ATOM 0 HA PRO A 72 3.720 12.927 -1.115 1.00 0.00 H new ATOM 0 HB2 PRO A 72 5.097 15.050 -0.121 1.00 0.00 H new ATOM 0 HB3 PRO A 72 3.572 14.652 0.646 1.00 0.00 H new ATOM 0 HG2 PRO A 72 6.341 14.228 1.648 1.00 0.00 H new ATOM 0 HG3 PRO A 72 4.853 14.396 2.558 1.00 0.00 H new ATOM 0 HD2 PRO A 72 6.198 11.923 1.768 1.00 0.00 H new ATOM 0 HD3 PRO A 72 4.786 12.097 2.790 1.00 0.00 H new ATOM 1260 N LYS A 82 13.498 1.639 2.600 1.00 0.00 N ATOM 1261 CA LYS A 82 13.246 1.748 4.032 1.00 0.00 C ATOM 1262 C LYS A 82 12.051 2.650 4.308 1.00 0.00 C ATOM 1263 O LYS A 82 11.328 2.448 5.283 1.00 0.00 O ATOM 1264 CB LYS A 82 14.482 2.296 4.749 1.00 0.00 C ATOM 1265 CG LYS A 82 14.852 1.522 6.003 1.00 0.00 C ATOM 1266 CD LYS A 82 15.540 2.413 7.025 1.00 0.00 C ATOM 1267 CE LYS A 82 14.569 2.891 8.092 1.00 0.00 C ATOM 1268 NZ LYS A 82 14.802 4.315 8.457 1.00 0.00 N ATOM 0 HA LYS A 82 13.023 0.750 4.411 1.00 0.00 H new ATOM 0 HB2 LYS A 82 15.327 2.281 4.061 1.00 0.00 H new ATOM 0 HB3 LYS A 82 14.305 3.338 5.015 1.00 0.00 H new ATOM 0 HG2 LYS A 82 13.954 1.089 6.443 1.00 0.00 H new ATOM 0 HG3 LYS A 82 15.510 0.694 5.740 1.00 0.00 H new ATOM 0 HD2 LYS A 82 16.357 1.866 7.495 1.00 0.00 H new ATOM 0 HD3 LYS A 82 15.981 3.273 6.521 1.00 0.00 H new ATOM 0 HE2 LYS A 82 13.547 2.771 7.733 1.00 0.00 H new ATOM 0 HE3 LYS A 82 14.670 2.267 8.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 14.120 4.602 9.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 15.769 4.426 8.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 14.681 4.913 7.615 1.00 0.00 H new ATOM 1282 N VAL A 83 11.816 3.619 3.432 1.00 0.00 N ATOM 1283 CA VAL A 83 10.666 4.493 3.600 1.00 0.00 C ATOM 1284 C VAL A 83 9.409 3.635 3.650 1.00 0.00 C ATOM 1285 O VAL A 83 8.572 3.765 4.551 1.00 0.00 O ATOM 1286 CB VAL A 83 10.547 5.513 2.452 1.00 0.00 C ATOM 1287 CG1 VAL A 83 9.409 6.488 2.717 1.00 0.00 C ATOM 1288 CG2 VAL A 83 11.860 6.255 2.259 1.00 0.00 C ATOM 0 H VAL A 83 12.394 3.816 2.615 1.00 0.00 H new ATOM 0 HA VAL A 83 10.791 5.055 4.526 1.00 0.00 H new ATOM 0 HB VAL A 83 10.323 4.972 1.533 1.00 0.00 H new ATOM 0 HG11 VAL A 83 9.341 7.200 1.895 1.00 0.00 H new ATOM 0 HG12 VAL A 83 8.471 5.939 2.799 1.00 0.00 H new ATOM 0 HG13 VAL A 83 9.598 7.024 3.647 1.00 0.00 H new ATOM 0 HG21 VAL A 83 11.757 6.971 1.444 1.00 0.00 H new ATOM 0 HG22 VAL A 83 12.117 6.784 3.177 1.00 0.00 H new ATOM 0 HG23 VAL A 83 12.649 5.542 2.018 1.00 0.00 H new ATOM 1298 N VAL A 84 9.314 2.714 2.690 1.00 0.00 N ATOM 1299 CA VAL A 84 8.195 1.787 2.628 1.00 0.00 C ATOM 1300 C VAL A 84 8.093 1.054 3.952 1.00 0.00 C ATOM 1301 O VAL A 84 7.004 0.855 4.490 1.00 0.00 O ATOM 1302 CB VAL A 84 8.368 0.769 1.483 1.00 0.00 C ATOM 1303 CG1 VAL A 84 7.330 -0.335 1.577 1.00 0.00 C ATOM 1304 CG2 VAL A 84 8.288 1.462 0.133 1.00 0.00 C ATOM 0 H VAL A 84 10.002 2.594 1.946 1.00 0.00 H new ATOM 0 HA VAL A 84 7.284 2.353 2.435 1.00 0.00 H new ATOM 0 HB VAL A 84 9.355 0.316 1.581 1.00 0.00 H new ATOM 0 HG11 VAL A 84 7.473 -1.040 0.758 1.00 0.00 H new ATOM 0 HG12 VAL A 84 7.439 -0.856 2.528 1.00 0.00 H new ATOM 0 HG13 VAL A 84 6.332 0.098 1.512 1.00 0.00 H new ATOM 0 HG21 VAL A 84 8.412 0.726 -0.662 1.00 0.00 H new ATOM 0 HG22 VAL A 84 7.317 1.947 0.030 1.00 0.00 H new ATOM 0 HG23 VAL A 84 9.077 2.211 0.061 1.00 0.00 H new ATOM 1314 N GLU A 85 9.252 0.682 4.485 1.00 0.00 N ATOM 1315 CA GLU A 85 9.309 0.001 5.767 1.00 0.00 C ATOM 1316 C GLU A 85 8.638 0.863 6.833 1.00 0.00 C ATOM 1317 O GLU A 85 8.044 0.350 7.781 1.00 0.00 O ATOM 1318 CB GLU A 85 10.760 -0.308 6.153 1.00 0.00 C ATOM 1319 CG GLU A 85 11.171 -1.747 5.874 1.00 0.00 C ATOM 1320 CD GLU A 85 12.557 -1.853 5.265 1.00 0.00 C ATOM 1321 OE1 GLU A 85 13.438 -1.057 5.655 1.00 0.00 O ATOM 1322 OE2 GLU A 85 12.764 -2.733 4.400 1.00 0.00 O ATOM 0 H GLU A 85 10.160 0.841 4.048 1.00 0.00 H new ATOM 0 HA GLU A 85 8.776 -0.947 5.690 1.00 0.00 H new ATOM 0 HB2 GLU A 85 11.423 0.363 5.607 1.00 0.00 H new ATOM 0 HB3 GLU A 85 10.898 -0.099 7.214 1.00 0.00 H new ATOM 0 HG2 GLU A 85 11.143 -2.315 6.804 1.00 0.00 H new ATOM 0 HG3 GLU A 85 10.446 -2.203 5.199 1.00 0.00 H new ATOM 1329 N ASP A 86 8.725 2.187 6.660 1.00 0.00 N ATOM 1330 CA ASP A 86 8.113 3.122 7.599 1.00 0.00 C ATOM 1331 C ASP A 86 6.599 2.961 7.592 1.00 0.00 C ATOM 1332 O ASP A 86 5.977 2.791 8.645 1.00 0.00 O ATOM 1333 CB ASP A 86 8.488 4.560 7.236 1.00 0.00 C ATOM 1334 CG ASP A 86 8.346 5.508 8.412 1.00 0.00 C ATOM 1335 OD1 ASP A 86 8.803 5.154 9.519 1.00 0.00 O ATOM 1336 OD2 ASP A 86 7.777 6.604 8.225 1.00 0.00 O ATOM 0 H ASP A 86 9.212 2.629 5.881 1.00 0.00 H new ATOM 0 HA ASP A 86 8.486 2.903 8.600 1.00 0.00 H new ATOM 0 HB2 ASP A 86 9.516 4.585 6.875 1.00 0.00 H new ATOM 0 HB3 ASP A 86 7.854 4.903 6.418 1.00 0.00 H new ATOM 1341 N TRP A 87 6.004 2.979 6.401 1.00 0.00 N ATOM 1342 CA TRP A 87 4.561 2.798 6.292 1.00 0.00 C ATOM 1343 C TRP A 87 4.196 1.381 6.730 1.00 0.00 C ATOM 1344 O TRP A 87 3.108 1.138 7.253 1.00 0.00 O ATOM 1345 CB TRP A 87 4.072 3.076 4.860 1.00 0.00 C ATOM 1346 CG TRP A 87 3.280 1.955 4.249 1.00 0.00 C ATOM 1347 CD1 TRP A 87 3.746 1.005 3.391 1.00 0.00 C ATOM 1348 CD2 TRP A 87 1.887 1.672 4.446 1.00 0.00 C ATOM 1349 NE1 TRP A 87 2.733 0.147 3.040 1.00 0.00 N ATOM 1350 CE2 TRP A 87 1.581 0.536 3.672 1.00 0.00 C ATOM 1351 CE3 TRP A 87 0.869 2.265 5.200 1.00 0.00 C ATOM 1352 CZ2 TRP A 87 0.302 -0.016 3.628 1.00 0.00 C ATOM 1353 CZ3 TRP A 87 -0.402 1.714 5.155 1.00 0.00 C ATOM 1354 CH2 TRP A 87 -0.675 0.584 4.373 1.00 0.00 C ATOM 0 H TRP A 87 6.489 3.115 5.514 1.00 0.00 H new ATOM 0 HA TRP A 87 4.064 3.514 6.946 1.00 0.00 H new ATOM 0 HB2 TRP A 87 3.459 3.977 4.866 1.00 0.00 H new ATOM 0 HB3 TRP A 87 4.935 3.282 4.227 1.00 0.00 H new ATOM 0 HD1 TRP A 87 4.764 0.937 3.038 1.00 0.00 H new ATOM 0 HE1 TRP A 87 2.823 -0.651 2.411 1.00 0.00 H new ATOM 0 HE3 TRP A 87 1.070 3.136 5.806 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 0.090 -0.887 3.026 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 -1.196 2.164 5.733 1.00 0.00 H new ATOM 0 HH2 TRP A 87 -1.676 0.179 4.358 1.00 0.00 H new ATOM 1365 N LEU A 88 5.127 0.452 6.520 1.00 0.00 N ATOM 1366 CA LEU A 88 4.923 -0.938 6.900 1.00 0.00 C ATOM 1367 C LEU A 88 4.744 -1.053 8.408 1.00 0.00 C ATOM 1368 O LEU A 88 3.925 -1.835 8.890 1.00 0.00 O ATOM 1369 CB LEU A 88 6.107 -1.791 6.444 1.00 0.00 C ATOM 1370 CG LEU A 88 5.976 -2.370 5.037 1.00 0.00 C ATOM 1371 CD1 LEU A 88 7.339 -2.759 4.488 1.00 0.00 C ATOM 1372 CD2 LEU A 88 5.040 -3.569 5.043 1.00 0.00 C ATOM 0 H LEU A 88 6.031 0.641 6.087 1.00 0.00 H new ATOM 0 HA LEU A 88 4.019 -1.303 6.412 1.00 0.00 H new ATOM 0 HB2 LEU A 88 7.012 -1.185 6.489 1.00 0.00 H new ATOM 0 HB3 LEU A 88 6.238 -2.612 7.149 1.00 0.00 H new ATOM 0 HG LEU A 88 5.553 -1.604 4.387 1.00 0.00 H new ATOM 0 HD11 LEU A 88 7.224 -3.169 3.485 1.00 0.00 H new ATOM 0 HD12 LEU A 88 7.980 -1.878 4.448 1.00 0.00 H new ATOM 0 HD13 LEU A 88 7.792 -3.509 5.137 1.00 0.00 H new ATOM 0 HD21 LEU A 88 4.957 -3.971 4.033 1.00 0.00 H new ATOM 0 HD22 LEU A 88 5.436 -4.337 5.707 1.00 0.00 H new ATOM 0 HD23 LEU A 88 4.055 -3.260 5.393 1.00 0.00 H new ATOM 1384 N SER A 89 5.511 -0.258 9.147 1.00 0.00 N ATOM 1385 CA SER A 89 5.430 -0.259 10.601 1.00 0.00 C ATOM 1386 C SER A 89 4.086 0.299 11.049 1.00 0.00 C ATOM 1387 O SER A 89 3.438 -0.248 11.941 1.00 0.00 O ATOM 1388 CB SER A 89 6.568 0.568 11.200 1.00 0.00 C ATOM 1389 OG SER A 89 7.053 -0.021 12.395 1.00 0.00 O ATOM 0 H SER A 89 6.195 0.394 8.762 1.00 0.00 H new ATOM 0 HA SER A 89 5.524 -1.286 10.954 1.00 0.00 H new ATOM 0 HB2 SER A 89 7.380 0.653 10.477 1.00 0.00 H new ATOM 0 HB3 SER A 89 6.217 1.579 11.406 1.00 0.00 H new ATOM 0 HG SER A 89 7.781 0.526 12.757 1.00 0.00 H new ATOM 1395 N LEU A 90 3.668 1.391 10.413 1.00 0.00 N ATOM 1396 CA LEU A 90 2.394 2.022 10.735 1.00 0.00 C ATOM 1397 C LEU A 90 1.238 1.052 10.496 1.00 0.00 C ATOM 1398 O LEU A 90 0.395 0.841 11.369 1.00 0.00 O ATOM 1399 CB LEU A 90 2.203 3.282 9.887 1.00 0.00 C ATOM 1400 CG LEU A 90 1.094 4.226 10.354 1.00 0.00 C ATOM 1401 CD1 LEU A 90 -0.273 3.593 10.148 1.00 0.00 C ATOM 1402 CD2 LEU A 90 1.296 4.604 11.815 1.00 0.00 C ATOM 0 H LEU A 90 4.194 1.856 9.673 1.00 0.00 H new ATOM 0 HA LEU A 90 2.402 2.299 11.789 1.00 0.00 H new ATOM 0 HB2 LEU A 90 3.143 3.834 9.870 1.00 0.00 H new ATOM 0 HB3 LEU A 90 1.992 2.980 8.861 1.00 0.00 H new ATOM 0 HG LEU A 90 1.142 5.135 9.754 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -1.047 4.281 10.487 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -0.418 3.376 9.090 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -0.335 2.667 10.720 1.00 0.00 H new ATOM 0 HD21 LEU A 90 0.498 5.276 12.131 1.00 0.00 H new ATOM 0 HD22 LEU A 90 1.277 3.704 12.430 1.00 0.00 H new ATOM 0 HD23 LEU A 90 2.258 5.103 11.932 1.00 0.00 H new ATOM 1414 N VAL A 91 1.212 0.462 9.305 1.00 0.00 N ATOM 1415 CA VAL A 91 0.167 -0.487 8.943 1.00 0.00 C ATOM 1416 C VAL A 91 0.300 -1.781 9.740 1.00 0.00 C ATOM 1417 O VAL A 91 -0.698 -2.397 10.114 1.00 0.00 O ATOM 1418 CB VAL A 91 0.202 -0.807 7.434 1.00 0.00 C ATOM 1419 CG1 VAL A 91 1.460 -1.582 7.074 1.00 0.00 C ATOM 1420 CG2 VAL A 91 -1.043 -1.576 7.019 1.00 0.00 C ATOM 0 H VAL A 91 1.904 0.625 8.574 1.00 0.00 H new ATOM 0 HA VAL A 91 -0.788 -0.020 9.182 1.00 0.00 H new ATOM 0 HB VAL A 91 0.218 0.136 6.887 1.00 0.00 H new ATOM 0 HG11 VAL A 91 1.462 -1.796 6.005 1.00 0.00 H new ATOM 0 HG12 VAL A 91 2.338 -0.988 7.327 1.00 0.00 H new ATOM 0 HG13 VAL A 91 1.483 -2.518 7.632 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -0.998 -1.792 5.951 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -1.096 -2.511 7.576 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -1.928 -0.977 7.231 1.00 0.00 H new ATOM 1430 N LYS A 92 1.541 -2.185 10.000 1.00 0.00 N ATOM 1431 CA LYS A 92 1.805 -3.404 10.756 1.00 0.00 C ATOM 1432 C LYS A 92 1.137 -3.346 12.125 1.00 0.00 C ATOM 1433 O LYS A 92 0.487 -4.300 12.552 1.00 0.00 O ATOM 1434 CB LYS A 92 3.312 -3.613 10.921 1.00 0.00 C ATOM 1435 CG LYS A 92 3.941 -4.423 9.799 1.00 0.00 C ATOM 1436 CD LYS A 92 3.944 -5.909 10.119 1.00 0.00 C ATOM 1437 CE LYS A 92 5.053 -6.267 11.095 1.00 0.00 C ATOM 1438 NZ LYS A 92 4.591 -7.229 12.133 1.00 0.00 N ATOM 0 H LYS A 92 2.378 -1.686 9.698 1.00 0.00 H new ATOM 0 HA LYS A 92 1.388 -4.244 10.200 1.00 0.00 H new ATOM 0 HB2 LYS A 92 3.801 -2.641 10.974 1.00 0.00 H new ATOM 0 HB3 LYS A 92 3.499 -4.116 11.870 1.00 0.00 H new ATOM 0 HG2 LYS A 92 3.393 -4.250 8.873 1.00 0.00 H new ATOM 0 HG3 LYS A 92 4.963 -4.083 9.633 1.00 0.00 H new ATOM 0 HD2 LYS A 92 2.980 -6.193 10.542 1.00 0.00 H new ATOM 0 HD3 LYS A 92 4.069 -6.480 9.199 1.00 0.00 H new ATOM 0 HE2 LYS A 92 5.892 -6.698 10.549 1.00 0.00 H new ATOM 0 HE3 LYS A 92 5.419 -5.360 11.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 5.377 -7.447 12.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 3.807 -6.808 12.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 4.266 -8.104 11.675 1.00 0.00 H new ATOM 1452 N ALA A 93 1.296 -2.217 12.806 1.00 0.00 N ATOM 1453 CA ALA A 93 0.705 -2.030 14.123 1.00 0.00 C ATOM 1454 C ALA A 93 -0.815 -1.994 14.036 1.00 0.00 C ATOM 1455 O ALA A 93 -1.510 -2.603 14.851 1.00 0.00 O ATOM 1456 CB ALA A 93 1.231 -0.753 14.762 1.00 0.00 C ATOM 0 H ALA A 93 1.830 -1.417 12.466 1.00 0.00 H new ATOM 0 HA ALA A 93 0.989 -2.877 14.748 1.00 0.00 H new ATOM 0 HB1 ALA A 93 0.780 -0.626 15.746 1.00 0.00 H new ATOM 0 HB2 ALA A 93 2.314 -0.817 14.864 1.00 0.00 H new ATOM 0 HB3 ALA A 93 0.976 0.100 14.134 1.00 0.00 H new ATOM 1462 N LYS A 94 -1.329 -1.277 13.041 1.00 0.00 N ATOM 1463 CA LYS A 94 -2.770 -1.164 12.847 1.00 0.00 C ATOM 1464 C LYS A 94 -3.372 -2.490 12.386 1.00 0.00 C ATOM 1465 O LYS A 94 -4.550 -2.761 12.619 1.00 0.00 O ATOM 1466 CB LYS A 94 -3.083 -0.067 11.828 1.00 0.00 C ATOM 1467 CG LYS A 94 -3.058 1.334 12.416 1.00 0.00 C ATOM 1468 CD LYS A 94 -4.449 1.792 12.825 1.00 0.00 C ATOM 1469 CE LYS A 94 -4.793 1.337 14.234 1.00 0.00 C ATOM 1470 NZ LYS A 94 -3.730 1.704 15.211 1.00 0.00 N ATOM 0 H LYS A 94 -0.770 -0.766 12.358 1.00 0.00 H new ATOM 0 HA LYS A 94 -3.217 -0.902 13.806 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -2.361 -0.123 11.013 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -4.066 -0.253 11.396 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -2.398 1.354 13.283 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -2.645 2.029 11.685 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -4.507 2.879 12.768 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -5.184 1.397 12.124 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -5.738 1.786 14.540 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -4.936 0.256 14.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -4.155 1.843 16.150 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -3.025 0.941 15.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -3.268 2.584 14.907 1.00 0.00 H new ATOM 1484 N PHE A 95 -2.559 -3.312 11.726 1.00 0.00 N ATOM 1485 CA PHE A 95 -3.017 -4.607 11.231 1.00 0.00 C ATOM 1486 C PHE A 95 -2.990 -5.661 12.333 1.00 0.00 C ATOM 1487 O PHE A 95 -3.979 -6.357 12.563 1.00 0.00 O ATOM 1488 CB PHE A 95 -2.155 -5.056 10.050 1.00 0.00 C ATOM 1489 CG PHE A 95 -2.614 -4.503 8.728 1.00 0.00 C ATOM 1490 CD1 PHE A 95 -3.276 -3.286 8.666 1.00 0.00 C ATOM 1491 CD2 PHE A 95 -2.387 -5.198 7.550 1.00 0.00 C ATOM 1492 CE1 PHE A 95 -3.700 -2.774 7.458 1.00 0.00 C ATOM 1493 CE2 PHE A 95 -2.810 -4.689 6.337 1.00 0.00 C ATOM 1494 CZ PHE A 95 -3.468 -3.475 6.292 1.00 0.00 C ATOM 0 H PHE A 95 -1.581 -3.104 11.522 1.00 0.00 H new ATOM 0 HA PHE A 95 -4.049 -4.494 10.897 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -1.124 -4.749 10.225 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -2.159 -6.145 10.001 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -3.462 -2.733 9.575 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -1.874 -6.148 7.581 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -4.214 -1.825 7.424 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -2.627 -5.239 5.426 1.00 0.00 H new ATOM 0 HZ PHE A 95 -3.800 -3.075 5.345 1.00 0.00 H new ATOM 1504 N CYS A 96 -1.854 -5.773 13.012 1.00 0.00 N ATOM 1505 CA CYS A 96 -1.705 -6.744 14.089 1.00 0.00 C ATOM 1506 C CYS A 96 -2.723 -6.490 15.196 1.00 0.00 C ATOM 1507 O CYS A 96 -3.263 -7.427 15.784 1.00 0.00 O ATOM 1508 CB CYS A 96 -0.287 -6.688 14.661 1.00 0.00 C ATOM 1509 SG CYS A 96 0.026 -7.890 15.975 1.00 0.00 S ATOM 0 H CYS A 96 -1.025 -5.205 12.836 1.00 0.00 H new ATOM 0 HA CYS A 96 -1.884 -7.737 13.677 1.00 0.00 H new ATOM 0 HB2 CYS A 96 0.426 -6.854 13.853 1.00 0.00 H new ATOM 0 HB3 CYS A 96 -0.102 -5.686 15.048 1.00 0.00 H new ATOM 0 HG CYS A 96 1.251 -7.767 16.393 1.00 0.00 H new ATOM 1515 N GLU A 97 -2.979 -5.216 15.475 1.00 0.00 N ATOM 1516 CA GLU A 97 -3.930 -4.836 16.514 1.00 0.00 C ATOM 1517 C GLU A 97 -5.370 -5.020 16.040 1.00 0.00 C ATOM 1518 O GLU A 97 -6.255 -5.342 16.832 1.00 0.00 O ATOM 1519 CB GLU A 97 -3.703 -3.383 16.933 1.00 0.00 C ATOM 1520 CG GLU A 97 -4.329 -3.032 18.273 1.00 0.00 C ATOM 1521 CD GLU A 97 -3.508 -2.024 19.053 1.00 0.00 C ATOM 1522 OE1 GLU A 97 -2.281 -2.224 19.175 1.00 0.00 O ATOM 1523 OE2 GLU A 97 -4.092 -1.034 19.543 1.00 0.00 O ATOM 0 H GLU A 97 -2.541 -4.429 14.996 1.00 0.00 H new ATOM 0 HA GLU A 97 -3.767 -5.488 17.372 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -2.631 -3.190 16.980 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -4.112 -2.724 16.167 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -5.329 -2.631 18.109 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -4.442 -3.940 18.866 1.00 0.00 H new ATOM 1530 N ALA A 98 -5.598 -4.807 14.747 1.00 0.00 N ATOM 1531 CA ALA A 98 -6.935 -4.945 14.178 1.00 0.00 C ATOM 1532 C ALA A 98 -6.939 -5.903 12.989 1.00 0.00 C ATOM 1533 O ALA A 98 -6.744 -5.488 11.846 1.00 0.00 O ATOM 1534 CB ALA A 98 -7.471 -3.584 13.761 1.00 0.00 C ATOM 0 H ALA A 98 -4.878 -4.539 14.076 1.00 0.00 H new ATOM 0 HA ALA A 98 -7.585 -5.364 14.946 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -8.469 -3.700 13.338 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -7.520 -2.930 14.632 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -6.809 -3.146 13.014 1.00 0.00 H new ATOM 1540 N PRO A 99 -7.164 -7.204 13.242 1.00 0.00 N ATOM 1541 CA PRO A 99 -7.196 -8.224 12.192 1.00 0.00 C ATOM 1542 C PRO A 99 -8.449 -8.123 11.327 1.00 0.00 C ATOM 1543 O PRO A 99 -9.555 -7.953 11.840 1.00 0.00 O ATOM 1544 CB PRO A 99 -7.187 -9.555 12.965 1.00 0.00 C ATOM 1545 CG PRO A 99 -6.918 -9.196 14.391 1.00 0.00 C ATOM 1546 CD PRO A 99 -7.402 -7.788 14.567 1.00 0.00 C ATOM 0 HA PRO A 99 -6.358 -8.116 11.503 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -8.142 -10.072 12.865 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -6.420 -10.226 12.579 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -7.438 -9.874 15.068 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -5.855 -9.273 14.618 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -8.456 -7.752 14.843 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -6.850 -7.263 15.347 1.00 0.00 H new ATOM 1554 N GLY A 100 -8.269 -8.232 10.015 1.00 0.00 N ATOM 1555 CA GLY A 100 -9.396 -8.152 9.100 1.00 0.00 C ATOM 1556 C GLY A 100 -10.161 -6.850 9.227 1.00 0.00 C ATOM 1557 O GLY A 100 -11.372 -6.853 9.454 1.00 0.00 O ATOM 0 H GLY A 100 -7.363 -8.374 9.568 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -9.036 -8.259 8.077 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -10.072 -8.986 9.289 1.00 0.00 H new ATOM 1561 N SER A 101 -9.456 -5.733 9.084 1.00 0.00 N ATOM 1562 CA SER A 101 -10.076 -4.417 9.189 1.00 0.00 C ATOM 1563 C SER A 101 -10.323 -3.809 7.808 1.00 0.00 C ATOM 1564 O SER A 101 -10.302 -4.510 6.796 1.00 0.00 O ATOM 1565 CB SER A 101 -9.197 -3.489 10.025 1.00 0.00 C ATOM 1566 OG SER A 101 -8.723 -4.147 11.188 1.00 0.00 O ATOM 0 H SER A 101 -8.454 -5.713 8.895 1.00 0.00 H new ATOM 0 HA SER A 101 -11.041 -4.535 9.681 1.00 0.00 H new ATOM 0 HB2 SER A 101 -8.352 -3.147 9.427 1.00 0.00 H new ATOM 0 HB3 SER A 101 -9.765 -2.604 10.310 1.00 0.00 H new ATOM 0 HG SER A 101 -7.802 -4.448 11.041 1.00 0.00 H new ATOM 1572 N CYS A 102 -10.561 -2.497 7.775 1.00 0.00 N ATOM 1573 CA CYS A 102 -10.819 -1.793 6.521 1.00 0.00 C ATOM 1574 C CYS A 102 -9.773 -0.710 6.267 1.00 0.00 C ATOM 1575 O CYS A 102 -9.703 0.279 6.990 1.00 0.00 O ATOM 1576 CB CYS A 102 -12.213 -1.177 6.585 1.00 0.00 C ATOM 1577 SG CYS A 102 -13.507 -2.294 5.989 1.00 0.00 S ATOM 0 H CYS A 102 -10.580 -1.902 8.603 1.00 0.00 H new ATOM 0 HA CYS A 102 -10.760 -2.503 5.696 1.00 0.00 H new ATOM 0 HB2 CYS A 102 -12.432 -0.893 7.614 1.00 0.00 H new ATOM 0 HB3 CYS A 102 -12.228 -0.263 5.992 1.00 0.00 H new ATOM 0 HG CYS A 102 -14.520 -1.598 5.567 1.00 0.00 H new ATOM 1583 N VAL A 103 -8.970 -0.897 5.223 1.00 0.00 N ATOM 1584 CA VAL A 103 -7.919 0.064 4.884 1.00 0.00 C ATOM 1585 C VAL A 103 -8.233 0.841 3.616 1.00 0.00 C ATOM 1586 O VAL A 103 -8.897 0.338 2.713 1.00 0.00 O ATOM 1587 CB VAL A 103 -6.556 -0.647 4.710 1.00 0.00 C ATOM 1588 CG1 VAL A 103 -5.535 0.261 4.026 1.00 0.00 C ATOM 1589 CG2 VAL A 103 -6.038 -1.123 6.055 1.00 0.00 C ATOM 0 H VAL A 103 -9.025 -1.701 4.598 1.00 0.00 H new ATOM 0 HA VAL A 103 -7.868 0.767 5.715 1.00 0.00 H new ATOM 0 HB VAL A 103 -6.706 -1.513 4.065 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -4.589 -0.270 3.920 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -5.904 0.546 3.041 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -5.383 1.156 4.629 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -5.078 -1.622 5.919 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -5.912 -0.268 6.720 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -6.751 -1.821 6.493 1.00 0.00 H new ATOM 1599 N ALA A 104 -7.717 2.067 3.551 1.00 0.00 N ATOM 1600 CA ALA A 104 -7.907 2.919 2.382 1.00 0.00 C ATOM 1601 C ALA A 104 -6.555 3.295 1.777 1.00 0.00 C ATOM 1602 O ALA A 104 -5.567 3.441 2.494 1.00 0.00 O ATOM 1603 CB ALA A 104 -8.719 4.156 2.744 1.00 0.00 C ATOM 0 H ALA A 104 -7.164 2.492 4.296 1.00 0.00 H new ATOM 0 HA ALA A 104 -8.470 2.365 1.631 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -8.849 4.778 1.858 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -9.696 3.853 3.121 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -8.194 4.724 3.512 1.00 0.00 H new ATOM 1609 N VAL A 105 -6.506 3.409 0.454 1.00 0.00 N ATOM 1610 CA VAL A 105 -5.257 3.722 -0.243 1.00 0.00 C ATOM 1611 C VAL A 105 -5.477 4.696 -1.403 1.00 0.00 C ATOM 1612 O VAL A 105 -6.611 4.939 -1.813 1.00 0.00 O ATOM 1613 CB VAL A 105 -4.604 2.431 -0.786 1.00 0.00 C ATOM 1614 CG1 VAL A 105 -3.148 2.667 -1.161 1.00 0.00 C ATOM 1615 CG2 VAL A 105 -4.721 1.303 0.231 1.00 0.00 C ATOM 0 H VAL A 105 -7.313 3.290 -0.159 1.00 0.00 H new ATOM 0 HA VAL A 105 -4.598 4.196 0.484 1.00 0.00 H new ATOM 0 HB VAL A 105 -5.139 2.139 -1.690 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -2.715 1.741 -1.540 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -3.091 3.436 -1.931 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -2.594 2.993 -0.281 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -4.256 0.402 -0.169 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -4.218 1.592 1.154 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -5.773 1.107 0.437 1.00 0.00 H new ATOM 1625 N HIS A 106 -4.381 5.254 -1.925 1.00 0.00 N ATOM 1626 CA HIS A 106 -4.450 6.203 -3.040 1.00 0.00 C ATOM 1627 C HIS A 106 -4.926 5.510 -4.324 1.00 0.00 C ATOM 1628 O HIS A 106 -4.798 4.295 -4.471 1.00 0.00 O ATOM 1629 CB HIS A 106 -3.078 6.856 -3.270 1.00 0.00 C ATOM 1630 CG HIS A 106 -2.891 7.404 -4.654 1.00 0.00 C ATOM 1631 ND1 HIS A 106 -2.730 6.771 -5.842 1.00 0.00 N flip ATOM 1632 CD2 HIS A 106 -2.872 8.751 -4.939 1.00 0.00 C flip ATOM 1633 CE1 HIS A 106 -2.622 7.738 -6.812 1.00 0.00 C flip ATOM 1634 NE2 HIS A 106 -2.710 8.925 -6.239 1.00 0.00 N flip ATOM 0 H HIS A 106 -3.435 5.065 -1.593 1.00 0.00 H new ATOM 0 HA HIS A 106 -5.173 6.977 -2.781 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -2.945 7.663 -2.549 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -2.298 6.120 -3.073 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -2.974 9.543 -4.212 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -2.487 7.558 -7.868 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -2.661 9.824 -6.719 1.00 0.00 H new ATOM 1642 N CYS A 107 -5.504 6.298 -5.234 1.00 0.00 N ATOM 1643 CA CYS A 107 -6.037 5.776 -6.494 1.00 0.00 C ATOM 1644 C CYS A 107 -4.936 5.296 -7.436 1.00 0.00 C ATOM 1645 O CYS A 107 -4.320 6.081 -8.160 1.00 0.00 O ATOM 1646 CB CYS A 107 -6.887 6.841 -7.192 1.00 0.00 C ATOM 1647 SG CYS A 107 -7.487 6.367 -8.831 1.00 0.00 S ATOM 0 H CYS A 107 -5.615 7.306 -5.120 1.00 0.00 H new ATOM 0 HA CYS A 107 -6.656 4.914 -6.246 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -7.743 7.076 -6.560 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -6.299 7.754 -7.284 1.00 0.00 H new ATOM 0 HG CYS A 107 -8.195 7.336 -9.331 1.00 0.00 H new ATOM 1653 N VAL A 108 -4.720 3.988 -7.420 1.00 0.00 N ATOM 1654 CA VAL A 108 -3.726 3.333 -8.261 1.00 0.00 C ATOM 1655 C VAL A 108 -4.184 3.212 -9.717 1.00 0.00 C ATOM 1656 O VAL A 108 -3.480 2.632 -10.542 1.00 0.00 O ATOM 1657 CB VAL A 108 -3.376 1.933 -7.732 1.00 0.00 C ATOM 1658 CG1 VAL A 108 -2.044 1.479 -8.299 1.00 0.00 C ATOM 1659 CG2 VAL A 108 -3.345 1.925 -6.212 1.00 0.00 C ATOM 0 H VAL A 108 -5.234 3.345 -6.818 1.00 0.00 H new ATOM 0 HA VAL A 108 -2.841 3.968 -8.226 1.00 0.00 H new ATOM 0 HB VAL A 108 -4.148 1.235 -8.056 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -1.806 0.486 -7.918 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -2.104 1.445 -9.387 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -1.264 2.179 -8.000 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -3.095 0.925 -5.858 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -2.594 2.632 -5.860 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -4.323 2.212 -5.827 1.00 0.00 H new ATOM 1669 N ALA A 109 -5.377 3.722 -10.033 1.00 0.00 N ATOM 1670 CA ALA A 109 -5.909 3.615 -11.392 1.00 0.00 C ATOM 1671 C ALA A 109 -4.990 4.281 -12.419 1.00 0.00 C ATOM 1672 O ALA A 109 -5.178 4.120 -13.625 1.00 0.00 O ATOM 1673 CB ALA A 109 -7.300 4.225 -11.459 1.00 0.00 C ATOM 0 H ALA A 109 -5.986 4.207 -9.374 1.00 0.00 H new ATOM 0 HA ALA A 109 -5.966 2.555 -11.641 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -7.686 4.140 -12.475 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -7.962 3.696 -10.773 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -7.250 5.277 -11.177 1.00 0.00 H new ATOM 1679 N GLY A 110 -3.977 4.991 -11.938 1.00 0.00 N ATOM 1680 CA GLY A 110 -3.021 5.624 -12.823 1.00 0.00 C ATOM 1681 C GLY A 110 -1.617 5.168 -12.491 1.00 0.00 C ATOM 1682 O GLY A 110 -1.333 3.970 -12.506 1.00 0.00 O ATOM 0 H GLY A 110 -3.801 5.140 -10.944 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -3.255 5.378 -13.859 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -3.090 6.708 -12.729 1.00 0.00 H new ATOM 1686 N LEU A 111 -0.754 6.113 -12.146 1.00 0.00 N ATOM 1687 CA LEU A 111 0.613 5.792 -11.758 1.00 0.00 C ATOM 1688 C LEU A 111 0.899 6.420 -10.400 1.00 0.00 C ATOM 1689 O LEU A 111 0.677 7.615 -10.207 1.00 0.00 O ATOM 1690 CB LEU A 111 1.619 6.302 -12.801 1.00 0.00 C ATOM 1691 CG LEU A 111 1.729 5.474 -14.091 1.00 0.00 C ATOM 1692 CD1 LEU A 111 3.039 5.773 -14.805 1.00 0.00 C ATOM 1693 CD2 LEU A 111 1.623 3.984 -13.800 1.00 0.00 C ATOM 0 H LEU A 111 -0.976 7.108 -12.127 1.00 0.00 H new ATOM 0 HA LEU A 111 0.721 4.709 -11.698 1.00 0.00 H new ATOM 0 HB2 LEU A 111 1.348 7.323 -13.070 1.00 0.00 H new ATOM 0 HB3 LEU A 111 2.604 6.346 -12.336 1.00 0.00 H new ATOM 0 HG LEU A 111 0.899 5.755 -14.739 1.00 0.00 H new ATOM 0 HD11 LEU A 111 3.101 5.178 -15.716 1.00 0.00 H new ATOM 0 HD12 LEU A 111 3.081 6.832 -15.059 1.00 0.00 H new ATOM 0 HD13 LEU A 111 3.875 5.523 -14.152 1.00 0.00 H new ATOM 0 HD21 LEU A 111 1.704 3.425 -14.732 1.00 0.00 H new ATOM 0 HD22 LEU A 111 2.427 3.687 -13.127 1.00 0.00 H new ATOM 0 HD23 LEU A 111 0.661 3.772 -13.332 1.00 0.00 H new ATOM 1705 N GLY A 112 1.373 5.616 -9.453 1.00 0.00 N ATOM 1706 CA GLY A 112 1.647 6.143 -8.131 1.00 0.00 C ATOM 1707 C GLY A 112 2.563 5.268 -7.301 1.00 0.00 C ATOM 1708 O GLY A 112 3.384 4.522 -7.835 1.00 0.00 O ATOM 0 H GLY A 112 1.570 4.623 -9.575 1.00 0.00 H new ATOM 0 HA2 GLY A 112 2.096 7.131 -8.230 1.00 0.00 H new ATOM 0 HA3 GLY A 112 0.704 6.273 -7.599 1.00 0.00 H new ATOM 1712 N ARG A 113 2.431 5.389 -5.985 1.00 0.00 N ATOM 1713 CA ARG A 113 3.258 4.638 -5.047 1.00 0.00 C ATOM 1714 C ARG A 113 2.407 3.779 -4.094 1.00 0.00 C ATOM 1715 O ARG A 113 2.910 2.847 -3.452 1.00 0.00 O ATOM 1716 CB ARG A 113 4.115 5.627 -4.249 1.00 0.00 C ATOM 1717 CG ARG A 113 4.789 6.695 -5.112 1.00 0.00 C ATOM 1718 CD ARG A 113 3.826 7.812 -5.530 1.00 0.00 C ATOM 1719 NE ARG A 113 4.539 9.049 -5.870 1.00 0.00 N ATOM 1720 CZ ARG A 113 3.997 10.272 -5.835 1.00 0.00 C ATOM 1721 NH1 ARG A 113 2.738 10.451 -5.463 1.00 0.00 N ATOM 1722 NH2 ARG A 113 4.719 11.329 -6.175 1.00 0.00 N ATOM 0 H ARG A 113 1.752 6.006 -5.540 1.00 0.00 H new ATOM 0 HA ARG A 113 3.894 3.955 -5.610 1.00 0.00 H new ATOM 0 HB2 ARG A 113 3.489 6.117 -3.504 1.00 0.00 H new ATOM 0 HB3 ARG A 113 4.882 5.074 -3.707 1.00 0.00 H new ATOM 0 HG2 ARG A 113 5.624 7.128 -4.561 1.00 0.00 H new ATOM 0 HG3 ARG A 113 5.205 6.226 -6.004 1.00 0.00 H new ATOM 0 HD2 ARG A 113 3.239 7.484 -6.388 1.00 0.00 H new ATOM 0 HD3 ARG A 113 3.124 8.008 -4.720 1.00 0.00 H new ATOM 0 HE ARG A 113 5.516 8.971 -6.153 1.00 0.00 H new ATOM 0 HH11 ARG A 113 2.166 9.649 -5.197 1.00 0.00 H new ATOM 0 HH12 ARG A 113 2.341 11.390 -5.442 1.00 0.00 H new ATOM 0 HH21 ARG A 113 5.690 11.212 -6.464 1.00 0.00 H new ATOM 0 HH22 ARG A 113 4.304 12.260 -6.148 1.00 0.00 H new ATOM 1736 N ALA A 114 1.119 4.105 -4.003 1.00 0.00 N ATOM 1737 CA ALA A 114 0.193 3.385 -3.132 1.00 0.00 C ATOM 1738 C ALA A 114 0.233 1.867 -3.339 1.00 0.00 C ATOM 1739 O ALA A 114 0.256 1.113 -2.367 1.00 0.00 O ATOM 1740 CB ALA A 114 -1.222 3.904 -3.344 1.00 0.00 C ATOM 0 H ALA A 114 0.691 4.869 -4.526 1.00 0.00 H new ATOM 0 HA ALA A 114 0.511 3.570 -2.106 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -1.909 3.364 -2.692 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -1.259 4.968 -3.108 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -1.513 3.753 -4.383 1.00 0.00 H new ATOM 1746 N PRO A 115 0.213 1.386 -4.598 1.00 0.00 N ATOM 1747 CA PRO A 115 0.212 -0.053 -4.893 1.00 0.00 C ATOM 1748 C PRO A 115 1.332 -0.814 -4.190 1.00 0.00 C ATOM 1749 O PRO A 115 1.081 -1.847 -3.569 1.00 0.00 O ATOM 1750 CB PRO A 115 0.414 -0.116 -6.416 1.00 0.00 C ATOM 1751 CG PRO A 115 0.784 1.271 -6.828 1.00 0.00 C ATOM 1752 CD PRO A 115 0.137 2.179 -5.828 1.00 0.00 C ATOM 0 HA PRO A 115 -0.709 -0.520 -4.543 1.00 0.00 H new ATOM 0 HB2 PRO A 115 1.199 -0.826 -6.679 1.00 0.00 H new ATOM 0 HB3 PRO A 115 -0.495 -0.445 -6.919 1.00 0.00 H new ATOM 0 HG2 PRO A 115 1.866 1.402 -6.833 1.00 0.00 H new ATOM 0 HG3 PRO A 115 0.432 1.486 -7.837 1.00 0.00 H new ATOM 0 HD2 PRO A 115 0.667 3.127 -5.735 1.00 0.00 H new ATOM 0 HD3 PRO A 115 -0.892 2.415 -6.098 1.00 0.00 H new ATOM 1760 N VAL A 116 2.560 -0.314 -4.273 1.00 0.00 N ATOM 1761 CA VAL A 116 3.673 -0.989 -3.618 1.00 0.00 C ATOM 1762 C VAL A 116 3.443 -1.035 -2.117 1.00 0.00 C ATOM 1763 O VAL A 116 3.649 -2.064 -1.478 1.00 0.00 O ATOM 1764 CB VAL A 116 5.028 -0.309 -3.895 1.00 0.00 C ATOM 1765 CG1 VAL A 116 6.167 -1.149 -3.335 1.00 0.00 C ATOM 1766 CG2 VAL A 116 5.223 -0.079 -5.383 1.00 0.00 C ATOM 0 H VAL A 116 2.807 0.538 -4.776 1.00 0.00 H new ATOM 0 HA VAL A 116 3.714 -1.997 -4.032 1.00 0.00 H new ATOM 0 HB VAL A 116 5.031 0.661 -3.397 1.00 0.00 H new ATOM 0 HG11 VAL A 116 7.117 -0.655 -3.539 1.00 0.00 H new ATOM 0 HG12 VAL A 116 6.040 -1.262 -2.258 1.00 0.00 H new ATOM 0 HG13 VAL A 116 6.160 -2.132 -3.806 1.00 0.00 H new ATOM 0 HG21 VAL A 116 6.186 0.402 -5.554 1.00 0.00 H new ATOM 0 HG22 VAL A 116 5.197 -1.035 -5.905 1.00 0.00 H new ATOM 0 HG23 VAL A 116 4.426 0.562 -5.760 1.00 0.00 H new ATOM 1776 N LEU A 117 3.013 0.090 -1.557 1.00 0.00 N ATOM 1777 CA LEU A 117 2.757 0.170 -0.125 1.00 0.00 C ATOM 1778 C LEU A 117 1.690 -0.839 0.314 1.00 0.00 C ATOM 1779 O LEU A 117 1.862 -1.534 1.317 1.00 0.00 O ATOM 1780 CB LEU A 117 2.343 1.593 0.261 1.00 0.00 C ATOM 1781 CG LEU A 117 3.339 2.698 -0.126 1.00 0.00 C ATOM 1782 CD1 LEU A 117 3.340 3.805 0.916 1.00 0.00 C ATOM 1783 CD2 LEU A 117 4.745 2.136 -0.297 1.00 0.00 C ATOM 0 H LEU A 117 2.835 0.954 -2.069 1.00 0.00 H new ATOM 0 HA LEU A 117 3.681 -0.082 0.395 1.00 0.00 H new ATOM 0 HB2 LEU A 117 1.383 1.813 -0.206 1.00 0.00 H new ATOM 0 HB3 LEU A 117 2.188 1.628 1.339 1.00 0.00 H new ATOM 0 HG LEU A 117 3.020 3.114 -1.081 1.00 0.00 H new ATOM 0 HD11 LEU A 117 4.051 4.578 0.625 1.00 0.00 H new ATOM 0 HD12 LEU A 117 2.342 4.238 0.988 1.00 0.00 H new ATOM 0 HD13 LEU A 117 3.627 3.394 1.884 1.00 0.00 H new ATOM 0 HD21 LEU A 117 5.428 2.941 -0.571 1.00 0.00 H new ATOM 0 HD22 LEU A 117 5.073 1.685 0.639 1.00 0.00 H new ATOM 0 HD23 LEU A 117 4.742 1.380 -1.082 1.00 0.00 H new ATOM 1795 N VAL A 118 0.590 -0.918 -0.430 1.00 0.00 N ATOM 1796 CA VAL A 118 -0.491 -1.846 -0.091 1.00 0.00 C ATOM 1797 C VAL A 118 0.012 -3.285 -0.002 1.00 0.00 C ATOM 1798 O VAL A 118 -0.175 -3.954 1.016 1.00 0.00 O ATOM 1799 CB VAL A 118 -1.641 -1.781 -1.117 1.00 0.00 C ATOM 1800 CG1 VAL A 118 -2.710 -2.817 -0.799 1.00 0.00 C ATOM 1801 CG2 VAL A 118 -2.245 -0.389 -1.149 1.00 0.00 C ATOM 0 H VAL A 118 0.422 -0.357 -1.265 1.00 0.00 H new ATOM 0 HA VAL A 118 -0.866 -1.536 0.884 1.00 0.00 H new ATOM 0 HB VAL A 118 -1.231 -2.006 -2.102 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -3.510 -2.752 -1.536 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -2.270 -3.814 -0.828 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -3.116 -2.628 0.195 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -3.055 -0.360 -1.878 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -2.636 -0.139 -0.163 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -1.479 0.334 -1.429 1.00 0.00 H new ATOM 1811 N ALA A 119 0.644 -3.759 -1.070 1.00 0.00 N ATOM 1812 CA ALA A 119 1.163 -5.121 -1.103 1.00 0.00 C ATOM 1813 C ALA A 119 2.051 -5.393 0.108 1.00 0.00 C ATOM 1814 O ALA A 119 1.896 -6.405 0.801 1.00 0.00 O ATOM 1815 CB ALA A 119 1.935 -5.359 -2.393 1.00 0.00 C ATOM 0 H ALA A 119 0.809 -3.222 -1.922 1.00 0.00 H new ATOM 0 HA ALA A 119 0.320 -5.811 -1.067 1.00 0.00 H new ATOM 0 HB1 ALA A 119 2.317 -6.380 -2.405 1.00 0.00 H new ATOM 0 HB2 ALA A 119 1.273 -5.209 -3.246 1.00 0.00 H new ATOM 0 HB3 ALA A 119 2.768 -4.659 -2.453 1.00 0.00 H new ATOM 1821 N LEU A 120 2.976 -4.477 0.364 1.00 0.00 N ATOM 1822 CA LEU A 120 3.882 -4.610 1.494 1.00 0.00 C ATOM 1823 C LEU A 120 3.100 -4.743 2.795 1.00 0.00 C ATOM 1824 O LEU A 120 3.541 -5.408 3.730 1.00 0.00 O ATOM 1825 CB LEU A 120 4.834 -3.416 1.559 1.00 0.00 C ATOM 1826 CG LEU A 120 6.111 -3.562 0.727 1.00 0.00 C ATOM 1827 CD1 LEU A 120 6.815 -4.872 1.044 1.00 0.00 C ATOM 1828 CD2 LEU A 120 5.802 -3.475 -0.760 1.00 0.00 C ATOM 0 H LEU A 120 3.117 -3.636 -0.195 1.00 0.00 H new ATOM 0 HA LEU A 120 4.474 -5.515 1.356 1.00 0.00 H new ATOM 0 HB2 LEU A 120 4.300 -2.526 1.225 1.00 0.00 H new ATOM 0 HB3 LEU A 120 5.113 -3.249 2.599 1.00 0.00 H new ATOM 0 HG LEU A 120 6.777 -2.740 0.989 1.00 0.00 H new ATOM 0 HD11 LEU A 120 7.719 -4.954 0.441 1.00 0.00 H new ATOM 0 HD12 LEU A 120 7.080 -4.896 2.101 1.00 0.00 H new ATOM 0 HD13 LEU A 120 6.151 -5.706 0.817 1.00 0.00 H new ATOM 0 HD21 LEU A 120 6.725 -3.581 -1.330 1.00 0.00 H new ATOM 0 HD22 LEU A 120 5.111 -4.272 -1.035 1.00 0.00 H new ATOM 0 HD23 LEU A 120 5.348 -2.509 -0.981 1.00 0.00 H new ATOM 1840 N ALA A 121 1.927 -4.122 2.847 1.00 0.00 N ATOM 1841 CA ALA A 121 1.086 -4.200 4.034 1.00 0.00 C ATOM 1842 C ALA A 121 0.499 -5.598 4.168 1.00 0.00 C ATOM 1843 O ALA A 121 0.326 -6.108 5.274 1.00 0.00 O ATOM 1844 CB ALA A 121 -0.022 -3.159 3.976 1.00 0.00 C ATOM 0 H ALA A 121 1.540 -3.563 2.087 1.00 0.00 H new ATOM 0 HA ALA A 121 1.701 -3.993 4.910 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -0.639 -3.234 4.872 1.00 0.00 H new ATOM 0 HB2 ALA A 121 0.417 -2.163 3.920 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -0.639 -3.333 3.095 1.00 0.00 H new ATOM 1850 N LEU A 122 0.211 -6.218 3.028 1.00 0.00 N ATOM 1851 CA LEU A 122 -0.339 -7.567 3.010 1.00 0.00 C ATOM 1852 C LEU A 122 0.748 -8.593 3.326 1.00 0.00 C ATOM 1853 O LEU A 122 0.455 -9.741 3.659 1.00 0.00 O ATOM 1854 CB LEU A 122 -0.970 -7.864 1.645 1.00 0.00 C ATOM 1855 CG LEU A 122 -2.427 -8.333 1.685 1.00 0.00 C ATOM 1856 CD1 LEU A 122 -3.251 -7.459 2.620 1.00 0.00 C ATOM 1857 CD2 LEU A 122 -3.026 -8.328 0.287 1.00 0.00 C ATOM 0 H LEU A 122 0.350 -5.807 2.105 1.00 0.00 H new ATOM 0 HA LEU A 122 -1.112 -7.636 3.776 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -0.912 -6.964 1.033 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -0.373 -8.628 1.146 1.00 0.00 H new ATOM 0 HG LEU A 122 -2.446 -9.354 2.067 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -4.283 -7.811 2.632 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -2.837 -7.513 3.627 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -3.224 -6.427 2.271 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -4.062 -8.664 0.334 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -2.990 -7.318 -0.121 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -2.456 -8.999 -0.356 1.00 0.00 H new ATOM 1869 N ILE A 123 2.005 -8.167 3.217 1.00 0.00 N ATOM 1870 CA ILE A 123 3.142 -9.040 3.490 1.00 0.00 C ATOM 1871 C ILE A 123 3.074 -9.609 4.909 1.00 0.00 C ATOM 1872 O ILE A 123 3.534 -10.723 5.162 1.00 0.00 O ATOM 1873 CB ILE A 123 4.477 -8.280 3.250 1.00 0.00 C ATOM 1874 CG1 ILE A 123 4.726 -8.174 1.735 1.00 0.00 C ATOM 1875 CG2 ILE A 123 5.665 -8.932 3.969 1.00 0.00 C ATOM 1876 CD1 ILE A 123 6.171 -7.928 1.345 1.00 0.00 C ATOM 0 H ILE A 123 2.261 -7.219 2.941 1.00 0.00 H new ATOM 0 HA ILE A 123 3.101 -9.883 2.800 1.00 0.00 H new ATOM 0 HB ILE A 123 4.385 -7.281 3.677 1.00 0.00 H new ATOM 0 HG12 ILE A 123 4.388 -9.095 1.260 1.00 0.00 H new ATOM 0 HG13 ILE A 123 4.114 -7.365 1.336 1.00 0.00 H new ATOM 0 HG21 ILE A 123 6.571 -8.360 3.767 1.00 0.00 H new ATOM 0 HG22 ILE A 123 5.477 -8.947 5.043 1.00 0.00 H new ATOM 0 HG23 ILE A 123 5.792 -9.953 3.609 1.00 0.00 H new ATOM 0 HD11 ILE A 123 6.250 -7.868 0.260 1.00 0.00 H new ATOM 0 HD12 ILE A 123 6.513 -6.992 1.786 1.00 0.00 H new ATOM 0 HD13 ILE A 123 6.791 -8.748 1.709 1.00 0.00 H new ATOM 1888 N GLU A 124 2.493 -8.850 5.827 1.00 0.00 N ATOM 1889 CA GLU A 124 2.367 -9.293 7.213 1.00 0.00 C ATOM 1890 C GLU A 124 1.294 -10.378 7.377 1.00 0.00 C ATOM 1891 O GLU A 124 1.245 -11.054 8.405 1.00 0.00 O ATOM 1892 CB GLU A 124 2.059 -8.104 8.130 1.00 0.00 C ATOM 1893 CG GLU A 124 0.632 -7.592 8.026 1.00 0.00 C ATOM 1894 CD GLU A 124 0.447 -6.254 8.713 1.00 0.00 C ATOM 1895 OE1 GLU A 124 0.446 -6.227 9.962 1.00 0.00 O ATOM 1896 OE2 GLU A 124 0.308 -5.236 8.005 1.00 0.00 O ATOM 0 H GLU A 124 2.102 -7.927 5.641 1.00 0.00 H new ATOM 0 HA GLU A 124 3.323 -9.730 7.500 1.00 0.00 H new ATOM 0 HB2 GLU A 124 2.255 -8.395 9.162 1.00 0.00 H new ATOM 0 HB3 GLU A 124 2.744 -7.290 7.893 1.00 0.00 H new ATOM 0 HG2 GLU A 124 0.358 -7.499 6.975 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -0.046 -8.322 8.469 1.00 0.00 H new ATOM 1903 N SER A 125 0.419 -10.519 6.383 1.00 0.00 N ATOM 1904 CA SER A 125 -0.667 -11.499 6.453 1.00 0.00 C ATOM 1905 C SER A 125 -0.203 -12.922 6.126 1.00 0.00 C ATOM 1906 O SER A 125 -0.841 -13.892 6.536 1.00 0.00 O ATOM 1907 CB SER A 125 -1.796 -11.097 5.503 1.00 0.00 C ATOM 1908 OG SER A 125 -3.049 -11.565 5.973 1.00 0.00 O ATOM 0 H SER A 125 0.439 -9.971 5.523 1.00 0.00 H new ATOM 0 HA SER A 125 -1.024 -11.503 7.483 1.00 0.00 H new ATOM 0 HB2 SER A 125 -1.823 -10.012 5.404 1.00 0.00 H new ATOM 0 HB3 SER A 125 -1.602 -11.503 4.510 1.00 0.00 H new ATOM 0 HG SER A 125 -3.717 -10.853 5.889 1.00 0.00 H new ATOM 1914 N GLY A 126 0.897 -13.052 5.391 1.00 0.00 N ATOM 1915 CA GLY A 126 1.394 -14.376 5.040 1.00 0.00 C ATOM 1916 C GLY A 126 2.138 -14.387 3.720 1.00 0.00 C ATOM 1917 O GLY A 126 3.318 -14.042 3.669 1.00 0.00 O ATOM 0 H GLY A 126 1.451 -12.274 5.033 1.00 0.00 H new ATOM 0 HA2 GLY A 126 2.056 -14.733 5.829 1.00 0.00 H new ATOM 0 HA3 GLY A 126 0.557 -15.072 4.987 1.00 0.00 H new ATOM 1921 N MET A 127 1.447 -14.775 2.646 1.00 0.00 N ATOM 1922 CA MET A 127 2.055 -14.809 1.316 1.00 0.00 C ATOM 1923 C MET A 127 2.455 -13.396 0.916 1.00 0.00 C ATOM 1924 O MET A 127 1.791 -12.749 0.116 1.00 0.00 O ATOM 1925 CB MET A 127 1.088 -15.404 0.283 1.00 0.00 C ATOM 1926 CG MET A 127 -0.362 -14.972 0.462 1.00 0.00 C ATOM 1927 SD MET A 127 -1.340 -15.189 -1.040 1.00 0.00 S ATOM 1928 CE MET A 127 -2.699 -14.058 -0.741 1.00 0.00 C ATOM 0 H MET A 127 0.471 -15.069 2.672 1.00 0.00 H new ATOM 0 HA MET A 127 2.939 -15.446 1.346 1.00 0.00 H new ATOM 0 HB2 MET A 127 1.420 -15.118 -0.715 1.00 0.00 H new ATOM 0 HB3 MET A 127 1.141 -16.491 0.337 1.00 0.00 H new ATOM 0 HG2 MET A 127 -0.812 -15.548 1.271 1.00 0.00 H new ATOM 0 HG3 MET A 127 -0.391 -13.925 0.762 1.00 0.00 H new ATOM 0 HE1 MET A 127 -2.915 -13.500 -1.652 1.00 0.00 H new ATOM 0 HE2 MET A 127 -3.583 -14.622 -0.442 1.00 0.00 H new ATOM 0 HE3 MET A 127 -2.426 -13.363 0.053 1.00 0.00 H new ATOM 1938 N LYS A 128 3.517 -12.911 1.536 1.00 0.00 N ATOM 1939 CA LYS A 128 3.990 -11.549 1.320 1.00 0.00 C ATOM 1940 C LYS A 128 4.469 -11.264 -0.100 1.00 0.00 C ATOM 1941 O LYS A 128 3.861 -10.467 -0.814 1.00 0.00 O ATOM 1942 CB LYS A 128 5.113 -11.239 2.309 1.00 0.00 C ATOM 1943 CG LYS A 128 6.102 -12.380 2.520 1.00 0.00 C ATOM 1944 CD LYS A 128 6.124 -12.842 3.968 1.00 0.00 C ATOM 1945 CE LYS A 128 6.767 -14.212 4.105 1.00 0.00 C ATOM 1946 NZ LYS A 128 8.200 -14.116 4.501 1.00 0.00 N ATOM 0 H LYS A 128 4.076 -13.445 2.201 1.00 0.00 H new ATOM 0 HA LYS A 128 3.128 -10.901 1.481 1.00 0.00 H new ATOM 0 HB2 LYS A 128 5.658 -10.363 1.958 1.00 0.00 H new ATOM 0 HB3 LYS A 128 4.671 -10.975 3.270 1.00 0.00 H new ATOM 0 HG2 LYS A 128 5.836 -13.217 1.875 1.00 0.00 H new ATOM 0 HG3 LYS A 128 7.100 -12.056 2.226 1.00 0.00 H new ATOM 0 HD2 LYS A 128 6.672 -12.120 4.573 1.00 0.00 H new ATOM 0 HD3 LYS A 128 5.106 -12.876 4.356 1.00 0.00 H new ATOM 0 HE2 LYS A 128 6.223 -14.796 4.848 1.00 0.00 H new ATOM 0 HE3 LYS A 128 6.687 -14.747 3.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 8.602 -15.072 4.584 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 8.724 -13.581 3.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 8.275 -13.628 5.416 1.00 0.00 H new ATOM 1960 N TYR A 129 5.568 -11.880 -0.497 1.00 0.00 N ATOM 1961 CA TYR A 129 6.126 -11.648 -1.820 1.00 0.00 C ATOM 1962 C TYR A 129 5.227 -12.238 -2.901 1.00 0.00 C ATOM 1963 O TYR A 129 5.130 -11.705 -4.007 1.00 0.00 O ATOM 1964 CB TYR A 129 7.535 -12.239 -1.887 1.00 0.00 C ATOM 1965 CG TYR A 129 8.328 -11.838 -3.114 1.00 0.00 C ATOM 1966 CD1 TYR A 129 8.171 -10.585 -3.693 1.00 0.00 C ATOM 1967 CD2 TYR A 129 9.244 -12.713 -3.687 1.00 0.00 C ATOM 1968 CE1 TYR A 129 8.903 -10.218 -4.807 1.00 0.00 C ATOM 1969 CE2 TYR A 129 9.976 -12.353 -4.800 1.00 0.00 C ATOM 1970 CZ TYR A 129 9.802 -11.105 -5.357 1.00 0.00 C ATOM 1971 OH TYR A 129 10.531 -10.742 -6.466 1.00 0.00 O ATOM 0 H TYR A 129 6.092 -12.543 0.075 1.00 0.00 H new ATOM 0 HA TYR A 129 6.186 -10.575 -2.000 1.00 0.00 H new ATOM 0 HB2 TYR A 129 8.086 -11.933 -0.998 1.00 0.00 H new ATOM 0 HB3 TYR A 129 7.461 -13.326 -1.857 1.00 0.00 H new ATOM 0 HD1 TYR A 129 7.466 -9.887 -3.266 1.00 0.00 H new ATOM 0 HD2 TYR A 129 9.385 -13.692 -3.253 1.00 0.00 H new ATOM 0 HE1 TYR A 129 8.770 -9.239 -5.244 1.00 0.00 H new ATOM 0 HE2 TYR A 129 10.682 -13.046 -5.232 1.00 0.00 H new ATOM 0 HH TYR A 129 11.119 -11.481 -6.727 1.00 0.00 H new ATOM 1981 N GLU A 130 4.561 -13.335 -2.567 1.00 0.00 N ATOM 1982 CA GLU A 130 3.659 -13.998 -3.502 1.00 0.00 C ATOM 1983 C GLU A 130 2.379 -13.191 -3.707 1.00 0.00 C ATOM 1984 O GLU A 130 1.976 -12.934 -4.842 1.00 0.00 O ATOM 1985 CB GLU A 130 3.320 -15.404 -3.004 1.00 0.00 C ATOM 1986 CG GLU A 130 4.529 -16.320 -2.905 1.00 0.00 C ATOM 1987 CD GLU A 130 4.936 -16.594 -1.470 1.00 0.00 C ATOM 1988 OE1 GLU A 130 5.535 -15.698 -0.840 1.00 0.00 O ATOM 1989 OE2 GLU A 130 4.657 -17.707 -0.976 1.00 0.00 O ATOM 0 H GLU A 130 4.628 -13.786 -1.655 1.00 0.00 H new ATOM 0 HA GLU A 130 4.169 -14.072 -4.463 1.00 0.00 H new ATOM 0 HB2 GLU A 130 2.849 -15.330 -2.024 1.00 0.00 H new ATOM 0 HB3 GLU A 130 2.588 -15.852 -3.676 1.00 0.00 H new ATOM 0 HG2 GLU A 130 4.307 -17.264 -3.403 1.00 0.00 H new ATOM 0 HG3 GLU A 130 5.367 -15.869 -3.437 1.00 0.00 H new ATOM 1996 N ASP A 131 1.737 -12.795 -2.608 1.00 0.00 N ATOM 1997 CA ASP A 131 0.500 -12.021 -2.691 1.00 0.00 C ATOM 1998 C ASP A 131 0.765 -10.637 -3.256 1.00 0.00 C ATOM 1999 O ASP A 131 -0.044 -10.097 -4.001 1.00 0.00 O ATOM 2000 CB ASP A 131 -0.157 -11.888 -1.318 1.00 0.00 C ATOM 2001 CG ASP A 131 -1.564 -11.333 -1.401 1.00 0.00 C ATOM 2002 OD1 ASP A 131 -2.186 -11.449 -2.477 1.00 0.00 O ATOM 2003 OD2 ASP A 131 -2.046 -10.784 -0.388 1.00 0.00 O ATOM 0 H ASP A 131 2.050 -12.995 -1.658 1.00 0.00 H new ATOM 0 HA ASP A 131 -0.175 -12.557 -3.358 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -0.183 -12.865 -0.835 1.00 0.00 H new ATOM 0 HB3 ASP A 131 0.451 -11.237 -0.689 1.00 0.00 H new ATOM 2008 N ALA A 132 1.896 -10.057 -2.891 1.00 0.00 N ATOM 2009 CA ALA A 132 2.239 -8.730 -3.369 1.00 0.00 C ATOM 2010 C ALA A 132 2.354 -8.710 -4.885 1.00 0.00 C ATOM 2011 O ALA A 132 1.764 -7.862 -5.542 1.00 0.00 O ATOM 2012 CB ALA A 132 3.529 -8.250 -2.725 1.00 0.00 C ATOM 0 H ALA A 132 2.586 -10.480 -2.271 1.00 0.00 H new ATOM 0 HA ALA A 132 1.437 -8.048 -3.085 1.00 0.00 H new ATOM 0 HB1 ALA A 132 3.771 -7.254 -3.095 1.00 0.00 H new ATOM 0 HB2 ALA A 132 3.404 -8.215 -1.643 1.00 0.00 H new ATOM 0 HB3 ALA A 132 4.338 -8.936 -2.975 1.00 0.00 H new ATOM 2018 N ILE A 133 3.112 -9.644 -5.440 1.00 0.00 N ATOM 2019 CA ILE A 133 3.288 -9.707 -6.884 1.00 0.00 C ATOM 2020 C ILE A 133 2.026 -10.216 -7.586 1.00 0.00 C ATOM 2021 O ILE A 133 1.676 -9.746 -8.669 1.00 0.00 O ATOM 2022 CB ILE A 133 4.483 -10.607 -7.261 1.00 0.00 C ATOM 2023 CG1 ILE A 133 5.736 -10.164 -6.502 1.00 0.00 C ATOM 2024 CG2 ILE A 133 4.728 -10.572 -8.764 1.00 0.00 C ATOM 2025 CD1 ILE A 133 6.263 -8.812 -6.933 1.00 0.00 C ATOM 0 H ILE A 133 3.612 -10.364 -4.918 1.00 0.00 H new ATOM 0 HA ILE A 133 3.487 -8.690 -7.221 1.00 0.00 H new ATOM 0 HB ILE A 133 4.248 -11.633 -6.979 1.00 0.00 H new ATOM 0 HG12 ILE A 133 5.512 -10.134 -5.436 1.00 0.00 H new ATOM 0 HG13 ILE A 133 6.518 -10.910 -6.642 1.00 0.00 H new ATOM 0 HG21 ILE A 133 5.575 -11.213 -9.010 1.00 0.00 H new ATOM 0 HG22 ILE A 133 3.840 -10.928 -9.286 1.00 0.00 H new ATOM 0 HG23 ILE A 133 4.945 -9.550 -9.074 1.00 0.00 H new ATOM 0 HD11 ILE A 133 7.151 -8.565 -6.351 1.00 0.00 H new ATOM 0 HD12 ILE A 133 6.519 -8.842 -7.992 1.00 0.00 H new ATOM 0 HD13 ILE A 133 5.498 -8.053 -6.766 1.00 0.00 H new ATOM 2037 N GLN A 134 1.355 -11.189 -6.974 1.00 0.00 N ATOM 2038 CA GLN A 134 0.146 -11.771 -7.559 1.00 0.00 C ATOM 2039 C GLN A 134 -1.067 -10.842 -7.454 1.00 0.00 C ATOM 2040 O GLN A 134 -1.767 -10.615 -8.442 1.00 0.00 O ATOM 2041 CB GLN A 134 -0.171 -13.107 -6.883 1.00 0.00 C ATOM 2042 CG GLN A 134 0.714 -14.251 -7.352 1.00 0.00 C ATOM 2043 CD GLN A 134 -0.082 -15.484 -7.736 1.00 0.00 C ATOM 2044 OE1 GLN A 134 0.225 -16.594 -7.303 1.00 0.00 O ATOM 2045 NE2 GLN A 134 -1.110 -15.293 -8.554 1.00 0.00 N ATOM 0 H GLN A 134 1.625 -11.591 -6.076 1.00 0.00 H new ATOM 0 HA GLN A 134 0.348 -11.924 -8.619 1.00 0.00 H new ATOM 0 HB2 GLN A 134 -0.063 -12.994 -5.804 1.00 0.00 H new ATOM 0 HB3 GLN A 134 -1.213 -13.363 -7.074 1.00 0.00 H new ATOM 0 HG2 GLN A 134 1.303 -13.922 -8.208 1.00 0.00 H new ATOM 0 HG3 GLN A 134 1.418 -14.509 -6.561 1.00 0.00 H new ATOM 0 HE21 GLN A 134 -1.328 -14.354 -8.888 1.00 0.00 H new ATOM 0 HE22 GLN A 134 -1.682 -16.085 -8.848 1.00 0.00 H new ATOM 2054 N PHE A 135 -1.322 -10.315 -6.259 1.00 0.00 N ATOM 2055 CA PHE A 135 -2.466 -9.429 -6.054 1.00 0.00 C ATOM 2056 C PHE A 135 -2.241 -8.085 -6.737 1.00 0.00 C ATOM 2057 O PHE A 135 -3.182 -7.474 -7.244 1.00 0.00 O ATOM 2058 CB PHE A 135 -2.748 -9.233 -4.555 1.00 0.00 C ATOM 2059 CG PHE A 135 -4.142 -9.614 -4.117 1.00 0.00 C ATOM 2060 CD1 PHE A 135 -4.899 -10.535 -4.831 1.00 0.00 C ATOM 2061 CD2 PHE A 135 -4.693 -9.050 -2.977 1.00 0.00 C ATOM 2062 CE1 PHE A 135 -6.172 -10.877 -4.417 1.00 0.00 C ATOM 2063 CE2 PHE A 135 -5.965 -9.390 -2.560 1.00 0.00 C ATOM 2064 CZ PHE A 135 -6.706 -10.303 -3.282 1.00 0.00 C ATOM 0 H PHE A 135 -0.759 -10.483 -5.425 1.00 0.00 H new ATOM 0 HA PHE A 135 -3.339 -9.900 -6.506 1.00 0.00 H new ATOM 0 HB2 PHE A 135 -2.030 -9.822 -3.985 1.00 0.00 H new ATOM 0 HB3 PHE A 135 -2.576 -8.187 -4.301 1.00 0.00 H new ATOM 0 HD1 PHE A 135 -4.487 -10.989 -5.720 1.00 0.00 H new ATOM 0 HD2 PHE A 135 -4.119 -8.334 -2.407 1.00 0.00 H new ATOM 0 HE1 PHE A 135 -6.749 -11.594 -4.982 1.00 0.00 H new ATOM 0 HE2 PHE A 135 -6.379 -8.941 -1.669 1.00 0.00 H new ATOM 0 HZ PHE A 135 -7.702 -10.568 -2.959 1.00 0.00 H new ATOM 2074 N ILE A 136 -0.991 -7.631 -6.764 1.00 0.00 N ATOM 2075 CA ILE A 136 -0.668 -6.366 -7.408 1.00 0.00 C ATOM 2076 C ILE A 136 -0.714 -6.515 -8.925 1.00 0.00 C ATOM 2077 O ILE A 136 -1.037 -5.569 -9.641 1.00 0.00 O ATOM 2078 CB ILE A 136 0.713 -5.831 -6.967 1.00 0.00 C ATOM 2079 CG1 ILE A 136 0.740 -4.306 -7.043 1.00 0.00 C ATOM 2080 CG2 ILE A 136 1.835 -6.431 -7.807 1.00 0.00 C ATOM 2081 CD1 ILE A 136 1.368 -3.656 -5.831 1.00 0.00 C ATOM 0 H ILE A 136 -0.194 -8.116 -6.351 1.00 0.00 H new ATOM 0 HA ILE A 136 -1.419 -5.640 -7.096 1.00 0.00 H new ATOM 0 HB ILE A 136 0.877 -6.133 -5.933 1.00 0.00 H new ATOM 0 HG12 ILE A 136 1.290 -4.004 -7.934 1.00 0.00 H new ATOM 0 HG13 ILE A 136 -0.279 -3.937 -7.157 1.00 0.00 H new ATOM 0 HG21 ILE A 136 2.793 -6.034 -7.471 1.00 0.00 H new ATOM 0 HG22 ILE A 136 1.833 -7.515 -7.696 1.00 0.00 H new ATOM 0 HG23 ILE A 136 1.683 -6.173 -8.855 1.00 0.00 H new ATOM 0 HD11 ILE A 136 1.354 -2.573 -5.951 1.00 0.00 H new ATOM 0 HD12 ILE A 136 0.805 -3.929 -4.939 1.00 0.00 H new ATOM 0 HD13 ILE A 136 2.398 -3.997 -5.728 1.00 0.00 H new ATOM 2093 N ARG A 137 -0.397 -7.715 -9.409 1.00 0.00 N ATOM 2094 CA ARG A 137 -0.417 -7.988 -10.840 1.00 0.00 C ATOM 2095 C ARG A 137 -1.841 -7.891 -11.377 1.00 0.00 C ATOM 2096 O ARG A 137 -2.093 -7.227 -12.383 1.00 0.00 O ATOM 2097 CB ARG A 137 0.160 -9.376 -11.130 1.00 0.00 C ATOM 2098 CG ARG A 137 1.599 -9.346 -11.619 1.00 0.00 C ATOM 2099 CD ARG A 137 1.673 -9.423 -13.136 1.00 0.00 C ATOM 2100 NE ARG A 137 1.718 -10.803 -13.613 1.00 0.00 N ATOM 2101 CZ ARG A 137 2.823 -11.546 -13.632 1.00 0.00 C ATOM 2102 NH1 ARG A 137 3.975 -11.048 -13.201 1.00 0.00 N ATOM 2103 NH2 ARG A 137 2.774 -12.792 -14.083 1.00 0.00 N ATOM 0 H ARG A 137 -0.124 -8.510 -8.831 1.00 0.00 H new ATOM 0 HA ARG A 137 0.201 -7.243 -11.341 1.00 0.00 H new ATOM 0 HB2 ARG A 137 0.105 -9.980 -10.224 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -0.460 -9.869 -11.879 1.00 0.00 H new ATOM 0 HG2 ARG A 137 2.082 -8.431 -11.276 1.00 0.00 H new ATOM 0 HG3 ARG A 137 2.150 -10.180 -11.184 1.00 0.00 H new ATOM 0 HD2 ARG A 137 0.808 -8.919 -13.567 1.00 0.00 H new ATOM 0 HD3 ARG A 137 2.558 -8.890 -13.483 1.00 0.00 H new ATOM 0 HE ARG A 137 0.852 -11.222 -13.951 1.00 0.00 H new ATOM 0 HH11 ARG A 137 4.018 -10.090 -12.852 1.00 0.00 H new ATOM 0 HH12 ARG A 137 4.817 -11.623 -13.218 1.00 0.00 H new ATOM 0 HH21 ARG A 137 1.891 -13.180 -14.415 1.00 0.00 H new ATOM 0 HH22 ARG A 137 3.619 -13.362 -14.098 1.00 0.00 H new ATOM 2117 N GLN A 138 -2.771 -8.555 -10.695 1.00 0.00 N ATOM 2118 CA GLN A 138 -4.173 -8.540 -11.099 1.00 0.00 C ATOM 2119 C GLN A 138 -4.718 -7.114 -11.094 1.00 0.00 C ATOM 2120 O GLN A 138 -5.398 -6.693 -12.030 1.00 0.00 O ATOM 2121 CB GLN A 138 -5.003 -9.424 -10.165 1.00 0.00 C ATOM 2122 CG GLN A 138 -5.344 -10.782 -10.753 1.00 0.00 C ATOM 2123 CD GLN A 138 -5.267 -11.896 -9.729 1.00 0.00 C ATOM 2124 OE1 GLN A 138 -5.205 -11.646 -8.525 1.00 0.00 O ATOM 2125 NE2 GLN A 138 -5.271 -13.137 -10.201 1.00 0.00 N ATOM 0 H GLN A 138 -2.579 -9.110 -9.861 1.00 0.00 H new ATOM 0 HA GLN A 138 -4.243 -8.934 -12.113 1.00 0.00 H new ATOM 0 HB2 GLN A 138 -4.455 -9.568 -9.234 1.00 0.00 H new ATOM 0 HB3 GLN A 138 -5.928 -8.904 -9.914 1.00 0.00 H new ATOM 0 HG2 GLN A 138 -6.349 -10.750 -11.174 1.00 0.00 H new ATOM 0 HG3 GLN A 138 -4.661 -11.000 -11.574 1.00 0.00 H new ATOM 0 HE21 GLN A 138 -5.324 -13.300 -11.207 1.00 0.00 H new ATOM 0 HE22 GLN A 138 -5.222 -13.927 -9.558 1.00 0.00 H new ATOM 2134 N LYS A 139 -4.407 -6.377 -10.034 1.00 0.00 N ATOM 2135 CA LYS A 139 -4.851 -4.995 -9.895 1.00 0.00 C ATOM 2136 C LYS A 139 -3.917 -4.052 -10.647 1.00 0.00 C ATOM 2137 O LYS A 139 -2.736 -4.347 -10.820 1.00 0.00 O ATOM 2138 CB LYS A 139 -4.913 -4.601 -8.418 1.00 0.00 C ATOM 2139 CG LYS A 139 -5.929 -5.398 -7.617 1.00 0.00 C ATOM 2140 CD LYS A 139 -7.353 -5.009 -7.982 1.00 0.00 C ATOM 2141 CE LYS A 139 -8.293 -6.201 -7.902 1.00 0.00 C ATOM 2142 NZ LYS A 139 -8.924 -6.322 -6.559 1.00 0.00 N ATOM 0 H LYS A 139 -3.845 -6.716 -9.253 1.00 0.00 H new ATOM 0 HA LYS A 139 -5.849 -4.913 -10.325 1.00 0.00 H new ATOM 0 HB2 LYS A 139 -3.927 -4.735 -7.973 1.00 0.00 H new ATOM 0 HB3 LYS A 139 -5.155 -3.541 -8.343 1.00 0.00 H new ATOM 0 HG2 LYS A 139 -5.783 -6.463 -7.799 1.00 0.00 H new ATOM 0 HG3 LYS A 139 -5.766 -5.231 -6.552 1.00 0.00 H new ATOM 0 HD2 LYS A 139 -7.701 -4.224 -7.310 1.00 0.00 H new ATOM 0 HD3 LYS A 139 -7.372 -4.596 -8.991 1.00 0.00 H new ATOM 0 HE2 LYS A 139 -9.070 -6.102 -8.660 1.00 0.00 H new ATOM 0 HE3 LYS A 139 -7.742 -7.114 -8.127 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 -8.727 -7.265 -6.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 -8.534 -5.595 -5.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 -9.952 -6.191 -6.645 1.00 0.00 H new ATOM 2156 N ARG A 140 -4.448 -2.922 -11.099 1.00 0.00 N ATOM 2157 CA ARG A 140 -3.641 -1.955 -11.834 1.00 0.00 C ATOM 2158 C ARG A 140 -2.691 -1.224 -10.893 1.00 0.00 C ATOM 2159 O ARG A 140 -3.123 -0.522 -9.978 1.00 0.00 O ATOM 2160 CB ARG A 140 -4.540 -0.946 -12.552 1.00 0.00 C ATOM 2161 CG ARG A 140 -3.961 -0.437 -13.863 1.00 0.00 C ATOM 2162 CD ARG A 140 -2.772 0.486 -13.634 1.00 0.00 C ATOM 2163 NE ARG A 140 -2.994 1.816 -14.198 1.00 0.00 N ATOM 2164 CZ ARG A 140 -3.179 2.049 -15.497 1.00 0.00 C ATOM 2165 NH1 ARG A 140 -3.144 1.051 -16.370 1.00 0.00 N ATOM 2166 NH2 ARG A 140 -3.394 3.286 -15.924 1.00 0.00 N ATOM 0 H ARG A 140 -5.424 -2.654 -10.971 1.00 0.00 H new ATOM 0 HA ARG A 140 -3.053 -2.496 -12.575 1.00 0.00 H new ATOM 0 HB2 ARG A 140 -5.507 -1.409 -12.748 1.00 0.00 H new ATOM 0 HB3 ARG A 140 -4.720 -0.098 -11.891 1.00 0.00 H new ATOM 0 HG2 ARG A 140 -3.652 -1.283 -14.477 1.00 0.00 H new ATOM 0 HG3 ARG A 140 -4.733 0.095 -14.419 1.00 0.00 H new ATOM 0 HD2 ARG A 140 -2.582 0.573 -12.564 1.00 0.00 H new ATOM 0 HD3 ARG A 140 -1.881 0.047 -14.082 1.00 0.00 H new ATOM 0 HE ARG A 140 -3.008 2.612 -13.560 1.00 0.00 H new ATOM 0 HH11 ARG A 140 -2.975 0.098 -16.049 1.00 0.00 H new ATOM 0 HH12 ARG A 140 -3.286 1.237 -17.363 1.00 0.00 H new ATOM 0 HH21 ARG A 140 -3.418 4.058 -15.258 1.00 0.00 H new ATOM 0 HH22 ARG A 140 -3.536 3.465 -16.918 1.00 0.00 H new ATOM 2180 N ARG A 141 -1.395 -1.397 -11.126 1.00 0.00 N ATOM 2181 CA ARG A 141 -0.371 -0.761 -10.305 1.00 0.00 C ATOM 2182 C ARG A 141 0.427 0.254 -11.117 1.00 0.00 C ATOM 2183 O ARG A 141 0.406 0.230 -12.347 1.00 0.00 O ATOM 2184 CB ARG A 141 0.570 -1.816 -9.723 1.00 0.00 C ATOM 2185 CG ARG A 141 1.310 -2.619 -10.780 1.00 0.00 C ATOM 2186 CD ARG A 141 0.577 -3.908 -11.114 1.00 0.00 C ATOM 2187 NE ARG A 141 0.880 -4.376 -12.464 1.00 0.00 N ATOM 2188 CZ ARG A 141 1.991 -5.033 -12.789 1.00 0.00 C ATOM 2189 NH1 ARG A 141 2.907 -5.301 -11.866 1.00 0.00 N ATOM 2190 NH2 ARG A 141 2.188 -5.424 -14.040 1.00 0.00 N ATOM 0 H ARG A 141 -1.027 -1.976 -11.881 1.00 0.00 H new ATOM 0 HA ARG A 141 -0.869 -0.236 -9.490 1.00 0.00 H new ATOM 0 HB2 ARG A 141 1.297 -1.325 -9.076 1.00 0.00 H new ATOM 0 HB3 ARG A 141 -0.005 -2.498 -9.097 1.00 0.00 H new ATOM 0 HG2 ARG A 141 1.422 -2.018 -11.683 1.00 0.00 H new ATOM 0 HG3 ARG A 141 2.314 -2.851 -10.425 1.00 0.00 H new ATOM 0 HD2 ARG A 141 0.851 -4.678 -10.393 1.00 0.00 H new ATOM 0 HD3 ARG A 141 -0.497 -3.750 -11.018 1.00 0.00 H new ATOM 0 HE ARG A 141 0.200 -4.188 -13.201 1.00 0.00 H new ATOM 0 HH11 ARG A 141 2.761 -5.003 -10.901 1.00 0.00 H new ATOM 0 HH12 ARG A 141 3.756 -5.805 -12.122 1.00 0.00 H new ATOM 0 HH21 ARG A 141 1.488 -5.221 -14.754 1.00 0.00 H new ATOM 0 HH22 ARG A 141 3.039 -5.927 -14.289 1.00 0.00 H new ATOM 2204 N GLY A 142 1.141 1.136 -10.423 1.00 0.00 N ATOM 2205 CA GLY A 142 1.947 2.131 -11.103 1.00 0.00 C ATOM 2206 C GLY A 142 3.010 1.482 -11.964 1.00 0.00 C ATOM 2207 O GLY A 142 2.871 0.319 -12.341 1.00 0.00 O ATOM 0 H GLY A 142 1.175 1.178 -9.404 1.00 0.00 H new ATOM 0 HA2 GLY A 142 1.307 2.759 -11.723 1.00 0.00 H new ATOM 0 HA3 GLY A 142 2.419 2.784 -10.369 1.00 0.00 H new ATOM 2211 N ALA A 143 4.080 2.208 -12.272 1.00 0.00 N ATOM 2212 CA ALA A 143 5.139 1.634 -13.086 1.00 0.00 C ATOM 2213 C ALA A 143 6.164 0.924 -12.205 1.00 0.00 C ATOM 2214 O ALA A 143 7.054 1.554 -11.636 1.00 0.00 O ATOM 2215 CB ALA A 143 5.814 2.714 -13.917 1.00 0.00 C ATOM 0 H ALA A 143 4.233 3.172 -11.977 1.00 0.00 H new ATOM 0 HA ALA A 143 4.697 0.902 -13.762 1.00 0.00 H new ATOM 0 HB1 ALA A 143 6.604 2.268 -14.521 1.00 0.00 H new ATOM 0 HB2 ALA A 143 5.079 3.183 -14.571 1.00 0.00 H new ATOM 0 HB3 ALA A 143 6.243 3.467 -13.256 1.00 0.00 H new ATOM 2221 N ILE A 144 6.031 -0.395 -12.112 1.00 0.00 N ATOM 2222 CA ILE A 144 6.943 -1.211 -11.318 1.00 0.00 C ATOM 2223 C ILE A 144 8.143 -1.656 -12.147 1.00 0.00 C ATOM 2224 O ILE A 144 8.001 -2.503 -13.029 1.00 0.00 O ATOM 2225 CB ILE A 144 6.215 -2.453 -10.759 1.00 0.00 C ATOM 2226 CG1 ILE A 144 5.185 -2.033 -9.710 1.00 0.00 C ATOM 2227 CG2 ILE A 144 7.206 -3.445 -10.169 1.00 0.00 C ATOM 2228 CD1 ILE A 144 4.407 -3.193 -9.125 1.00 0.00 C ATOM 0 H ILE A 144 5.295 -0.925 -12.580 1.00 0.00 H new ATOM 0 HA ILE A 144 7.297 -0.598 -10.489 1.00 0.00 H new ATOM 0 HB ILE A 144 5.696 -2.946 -11.581 1.00 0.00 H new ATOM 0 HG12 ILE A 144 5.694 -1.505 -8.904 1.00 0.00 H new ATOM 0 HG13 ILE A 144 4.486 -1.328 -10.161 1.00 0.00 H new ATOM 0 HG21 ILE A 144 6.668 -4.310 -9.782 1.00 0.00 H new ATOM 0 HG22 ILE A 144 7.903 -3.767 -10.943 1.00 0.00 H new ATOM 0 HG23 ILE A 144 7.758 -2.969 -9.359 1.00 0.00 H new ATOM 0 HD11 ILE A 144 3.695 -2.819 -8.389 1.00 0.00 H new ATOM 0 HD12 ILE A 144 3.869 -3.708 -9.921 1.00 0.00 H new ATOM 0 HD13 ILE A 144 5.096 -3.887 -8.644 1.00 0.00 H new ATOM 2240 N ASN A 145 9.326 -1.107 -11.873 1.00 0.00 N ATOM 2241 CA ASN A 145 10.504 -1.510 -12.632 1.00 0.00 C ATOM 2242 C ASN A 145 11.539 -2.247 -11.777 1.00 0.00 C ATOM 2243 O ASN A 145 11.658 -3.470 -11.852 1.00 0.00 O ATOM 2244 CB ASN A 145 11.147 -0.284 -13.287 1.00 0.00 C ATOM 2245 CG ASN A 145 12.343 -0.645 -14.147 1.00 0.00 C ATOM 2246 OD1 ASN A 145 13.530 -0.613 -13.554 1.00 0.00 O flip ATOM 2247 ND2 ASN A 145 12.200 -0.951 -15.332 1.00 0.00 N flip ATOM 0 H ASN A 145 9.491 -0.403 -11.153 1.00 0.00 H new ATOM 0 HA ASN A 145 10.166 -2.209 -13.397 1.00 0.00 H new ATOM 0 HB2 ASN A 145 10.405 0.228 -13.899 1.00 0.00 H new ATOM 0 HB3 ASN A 145 11.459 0.416 -12.512 1.00 0.00 H new ATOM 0 HD21 ASN A 145 11.268 -0.962 -15.747 1.00 0.00 H new ATOM 0 HD22 ASN A 145 13.013 -1.193 -15.898 1.00 0.00 H new ATOM 2254 N SER A 146 12.304 -1.495 -10.986 1.00 0.00 N ATOM 2255 CA SER A 146 13.347 -2.083 -10.145 1.00 0.00 C ATOM 2256 C SER A 146 12.957 -2.242 -8.672 1.00 0.00 C ATOM 2257 O SER A 146 12.997 -3.342 -8.119 1.00 0.00 O ATOM 2258 CB SER A 146 14.620 -1.243 -10.242 1.00 0.00 C ATOM 2259 OG SER A 146 14.314 0.131 -10.407 1.00 0.00 O ATOM 0 H SER A 146 12.222 -0.481 -10.910 1.00 0.00 H new ATOM 0 HA SER A 146 13.507 -3.090 -10.529 1.00 0.00 H new ATOM 0 HB2 SER A 146 15.219 -1.380 -9.342 1.00 0.00 H new ATOM 0 HB3 SER A 146 15.224 -1.588 -11.082 1.00 0.00 H new ATOM 0 HG SER A 146 15.145 0.647 -10.465 1.00 0.00 H new ATOM 2265 N LYS A 147 12.664 -1.114 -8.031 1.00 0.00 N ATOM 2266 CA LYS A 147 12.359 -1.074 -6.599 1.00 0.00 C ATOM 2267 C LYS A 147 11.329 -2.099 -6.135 1.00 0.00 C ATOM 2268 O LYS A 147 11.570 -2.804 -5.167 1.00 0.00 O ATOM 2269 CB LYS A 147 11.883 0.326 -6.201 1.00 0.00 C ATOM 2270 CG LYS A 147 12.199 0.690 -4.755 1.00 0.00 C ATOM 2271 CD LYS A 147 11.090 0.254 -3.806 1.00 0.00 C ATOM 2272 CE LYS A 147 11.155 1.008 -2.481 1.00 0.00 C ATOM 2273 NZ LYS A 147 10.659 0.183 -1.340 1.00 0.00 N ATOM 0 H LYS A 147 12.631 -0.202 -8.486 1.00 0.00 H new ATOM 0 HA LYS A 147 13.294 -1.332 -6.102 1.00 0.00 H new ATOM 0 HB2 LYS A 147 12.346 1.059 -6.861 1.00 0.00 H new ATOM 0 HB3 LYS A 147 10.806 0.392 -6.357 1.00 0.00 H new ATOM 0 HG2 LYS A 147 13.137 0.220 -4.459 1.00 0.00 H new ATOM 0 HG3 LYS A 147 12.343 1.767 -4.675 1.00 0.00 H new ATOM 0 HD2 LYS A 147 10.121 0.425 -4.275 1.00 0.00 H new ATOM 0 HD3 LYS A 147 11.170 -0.817 -3.620 1.00 0.00 H new ATOM 0 HE2 LYS A 147 12.184 1.312 -2.288 1.00 0.00 H new ATOM 0 HE3 LYS A 147 10.562 1.919 -2.554 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 10.464 0.799 -0.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 9.786 -0.307 -1.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 11.381 -0.518 -1.079 1.00 0.00 H new ATOM 2287 N GLN A 148 10.174 -2.159 -6.776 1.00 0.00 N ATOM 2288 CA GLN A 148 9.123 -3.078 -6.333 1.00 0.00 C ATOM 2289 C GLN A 148 9.583 -4.534 -6.270 1.00 0.00 C ATOM 2290 O GLN A 148 9.391 -5.206 -5.254 1.00 0.00 O ATOM 2291 CB GLN A 148 7.900 -2.963 -7.241 1.00 0.00 C ATOM 2292 CG GLN A 148 6.589 -2.843 -6.480 1.00 0.00 C ATOM 2293 CD GLN A 148 6.102 -4.174 -5.944 1.00 0.00 C ATOM 2294 OE1 GLN A 148 5.537 -4.983 -6.680 1.00 0.00 O ATOM 2295 NE2 GLN A 148 6.320 -4.408 -4.655 1.00 0.00 N ATOM 0 H GLN A 148 9.936 -1.595 -7.592 1.00 0.00 H new ATOM 0 HA GLN A 148 8.864 -2.781 -5.317 1.00 0.00 H new ATOM 0 HB2 GLN A 148 8.017 -2.093 -7.887 1.00 0.00 H new ATOM 0 HB3 GLN A 148 7.856 -3.838 -7.890 1.00 0.00 H new ATOM 0 HG2 GLN A 148 6.717 -2.147 -5.651 1.00 0.00 H new ATOM 0 HG3 GLN A 148 5.829 -2.420 -7.137 1.00 0.00 H new ATOM 0 HE21 GLN A 148 6.792 -3.708 -4.082 1.00 0.00 H new ATOM 0 HE22 GLN A 148 6.015 -5.287 -4.238 1.00 0.00 H new ATOM 2304 N LEU A 149 10.163 -5.030 -7.352 1.00 0.00 N ATOM 2305 CA LEU A 149 10.608 -6.419 -7.398 1.00 0.00 C ATOM 2306 C LEU A 149 11.860 -6.651 -6.557 1.00 0.00 C ATOM 2307 O LEU A 149 11.930 -7.612 -5.793 1.00 0.00 O ATOM 2308 CB LEU A 149 10.854 -6.844 -8.845 1.00 0.00 C ATOM 2309 CG LEU A 149 9.586 -7.135 -9.650 1.00 0.00 C ATOM 2310 CD1 LEU A 149 8.944 -8.432 -9.182 1.00 0.00 C ATOM 2311 CD2 LEU A 149 8.603 -5.980 -9.528 1.00 0.00 C ATOM 0 H LEU A 149 10.337 -4.498 -8.205 1.00 0.00 H new ATOM 0 HA LEU A 149 9.814 -7.031 -6.970 1.00 0.00 H new ATOM 0 HB2 LEU A 149 11.416 -6.058 -9.350 1.00 0.00 H new ATOM 0 HB3 LEU A 149 11.481 -7.735 -8.846 1.00 0.00 H new ATOM 0 HG LEU A 149 9.861 -7.246 -10.699 1.00 0.00 H new ATOM 0 HD11 LEU A 149 8.043 -8.623 -9.765 1.00 0.00 H new ATOM 0 HD12 LEU A 149 9.646 -9.255 -9.317 1.00 0.00 H new ATOM 0 HD13 LEU A 149 8.682 -8.348 -8.127 1.00 0.00 H new ATOM 0 HD21 LEU A 149 7.706 -6.203 -10.106 1.00 0.00 H new ATOM 0 HD22 LEU A 149 8.334 -5.840 -8.481 1.00 0.00 H new ATOM 0 HD23 LEU A 149 9.063 -5.069 -9.909 1.00 0.00 H new ATOM 2323 N THR A 150 12.848 -5.780 -6.707 1.00 0.00 N ATOM 2324 CA THR A 150 14.098 -5.913 -5.964 1.00 0.00 C ATOM 2325 C THR A 150 13.894 -5.696 -4.466 1.00 0.00 C ATOM 2326 O THR A 150 14.530 -6.356 -3.644 1.00 0.00 O ATOM 2327 CB THR A 150 15.132 -4.922 -6.494 1.00 0.00 C ATOM 2328 OG1 THR A 150 15.319 -5.088 -7.889 1.00 0.00 O ATOM 2329 CG2 THR A 150 16.486 -5.055 -5.830 1.00 0.00 C ATOM 0 H THR A 150 12.811 -4.976 -7.333 1.00 0.00 H new ATOM 0 HA THR A 150 14.459 -6.931 -6.108 1.00 0.00 H new ATOM 0 HB THR A 150 14.729 -3.936 -6.265 1.00 0.00 H new ATOM 0 HG1 THR A 150 14.634 -4.582 -8.373 1.00 0.00 H new ATOM 0 HG21 THR A 150 17.172 -4.322 -6.253 1.00 0.00 H new ATOM 0 HG22 THR A 150 16.385 -4.881 -4.759 1.00 0.00 H new ATOM 0 HG23 THR A 150 16.877 -6.058 -5.999 1.00 0.00 H new ATOM 2337 N TYR A 151 13.017 -4.762 -4.113 1.00 0.00 N ATOM 2338 CA TYR A 151 12.753 -4.458 -2.711 1.00 0.00 C ATOM 2339 C TYR A 151 12.050 -5.620 -2.014 1.00 0.00 C ATOM 2340 O TYR A 151 12.489 -6.072 -0.953 1.00 0.00 O ATOM 2341 CB TYR A 151 11.915 -3.179 -2.618 1.00 0.00 C ATOM 2342 CG TYR A 151 11.058 -3.064 -1.385 1.00 0.00 C ATOM 2343 CD1 TYR A 151 11.555 -3.368 -0.127 1.00 0.00 C ATOM 2344 CD2 TYR A 151 9.743 -2.643 -1.491 1.00 0.00 C ATOM 2345 CE1 TYR A 151 10.760 -3.255 0.994 1.00 0.00 C ATOM 2346 CE2 TYR A 151 8.940 -2.525 -0.382 1.00 0.00 C ATOM 2347 CZ TYR A 151 9.453 -2.833 0.865 1.00 0.00 C ATOM 2348 OH TYR A 151 8.661 -2.719 1.983 1.00 0.00 O ATOM 0 H TYR A 151 12.479 -4.204 -4.776 1.00 0.00 H new ATOM 0 HA TYR A 151 13.704 -4.303 -2.201 1.00 0.00 H new ATOM 0 HB2 TYR A 151 12.585 -2.320 -2.657 1.00 0.00 H new ATOM 0 HB3 TYR A 151 11.271 -3.121 -3.496 1.00 0.00 H new ATOM 0 HD1 TYR A 151 12.578 -3.698 -0.024 1.00 0.00 H new ATOM 0 HD2 TYR A 151 9.341 -2.403 -2.464 1.00 0.00 H new ATOM 0 HE1 TYR A 151 11.159 -3.496 1.968 1.00 0.00 H new ATOM 0 HE2 TYR A 151 7.917 -2.194 -0.483 1.00 0.00 H new ATOM 0 HH TYR A 151 9.121 -2.175 2.656 1.00 0.00 H new ATOM 2358 N LEU A 152 10.967 -6.114 -2.605 1.00 0.00 N ATOM 2359 CA LEU A 152 10.250 -7.225 -2.002 1.00 0.00 C ATOM 2360 C LEU A 152 11.067 -8.503 -2.111 1.00 0.00 C ATOM 2361 O LEU A 152 11.015 -9.362 -1.229 1.00 0.00 O ATOM 2362 CB LEU A 152 8.866 -7.405 -2.624 1.00 0.00 C ATOM 2363 CG LEU A 152 7.751 -7.595 -1.594 1.00 0.00 C ATOM 2364 CD1 LEU A 152 6.383 -7.548 -2.250 1.00 0.00 C ATOM 2365 CD2 LEU A 152 7.939 -8.902 -0.843 1.00 0.00 C ATOM 0 H LEU A 152 10.575 -5.770 -3.482 1.00 0.00 H new ATOM 0 HA LEU A 152 10.103 -6.996 -0.947 1.00 0.00 H new ATOM 0 HB2 LEU A 152 8.637 -6.534 -3.238 1.00 0.00 H new ATOM 0 HB3 LEU A 152 8.885 -8.268 -3.289 1.00 0.00 H new ATOM 0 HG LEU A 152 7.808 -6.772 -0.881 1.00 0.00 H new ATOM 0 HD11 LEU A 152 5.611 -7.686 -1.493 1.00 0.00 H new ATOM 0 HD12 LEU A 152 6.246 -6.582 -2.736 1.00 0.00 H new ATOM 0 HD13 LEU A 152 6.308 -8.342 -2.993 1.00 0.00 H new ATOM 0 HD21 LEU A 152 7.137 -9.021 -0.114 1.00 0.00 H new ATOM 0 HD22 LEU A 152 7.916 -9.733 -1.548 1.00 0.00 H new ATOM 0 HD23 LEU A 152 8.899 -8.890 -0.327 1.00 0.00 H new ATOM 2377 N GLU A 153 11.857 -8.611 -3.177 1.00 0.00 N ATOM 2378 CA GLU A 153 12.714 -9.774 -3.359 1.00 0.00 C ATOM 2379 C GLU A 153 13.660 -9.874 -2.167 1.00 0.00 C ATOM 2380 O GLU A 153 13.927 -10.960 -1.652 1.00 0.00 O ATOM 2381 CB GLU A 153 13.515 -9.659 -4.659 1.00 0.00 C ATOM 2382 CG GLU A 153 14.416 -10.855 -4.925 1.00 0.00 C ATOM 2383 CD GLU A 153 15.817 -10.450 -5.338 1.00 0.00 C ATOM 2384 OE1 GLU A 153 16.571 -9.955 -4.473 1.00 0.00 O ATOM 2385 OE2 GLU A 153 16.161 -10.628 -6.525 1.00 0.00 O ATOM 0 H GLU A 153 11.920 -7.914 -3.919 1.00 0.00 H new ATOM 0 HA GLU A 153 12.098 -10.671 -3.423 1.00 0.00 H new ATOM 0 HB2 GLU A 153 12.823 -9.543 -5.493 1.00 0.00 H new ATOM 0 HB3 GLU A 153 14.125 -8.756 -4.622 1.00 0.00 H new ATOM 0 HG2 GLU A 153 14.470 -11.471 -4.027 1.00 0.00 H new ATOM 0 HG3 GLU A 153 13.974 -11.471 -5.708 1.00 0.00 H new ATOM 2392 N LYS A 154 14.133 -8.710 -1.719 1.00 0.00 N ATOM 2393 CA LYS A 154 15.020 -8.626 -0.565 1.00 0.00 C ATOM 2394 C LYS A 154 14.232 -8.934 0.705 1.00 0.00 C ATOM 2395 O LYS A 154 14.777 -9.440 1.685 1.00 0.00 O ATOM 2396 CB LYS A 154 15.646 -7.225 -0.483 1.00 0.00 C ATOM 2397 CG LYS A 154 16.124 -6.828 0.909 1.00 0.00 C ATOM 2398 CD LYS A 154 14.984 -6.280 1.760 1.00 0.00 C ATOM 2399 CE LYS A 154 15.104 -4.776 1.964 1.00 0.00 C ATOM 2400 NZ LYS A 154 14.639 -4.355 3.318 1.00 0.00 N ATOM 0 H LYS A 154 13.913 -7.809 -2.143 1.00 0.00 H new ATOM 0 HA LYS A 154 15.823 -9.356 -0.670 1.00 0.00 H new ATOM 0 HB2 LYS A 154 16.490 -7.177 -1.171 1.00 0.00 H new ATOM 0 HB3 LYS A 154 14.914 -6.493 -0.825 1.00 0.00 H new ATOM 0 HG2 LYS A 154 16.564 -7.694 1.404 1.00 0.00 H new ATOM 0 HG3 LYS A 154 16.909 -6.076 0.824 1.00 0.00 H new ATOM 0 HD2 LYS A 154 14.031 -6.507 1.281 1.00 0.00 H new ATOM 0 HD3 LYS A 154 14.981 -6.779 2.729 1.00 0.00 H new ATOM 0 HE2 LYS A 154 16.142 -4.474 1.827 1.00 0.00 H new ATOM 0 HE3 LYS A 154 14.519 -4.259 1.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 13.870 -3.661 3.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 14.292 -5.185 3.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 15.430 -3.925 3.838 1.00 0.00 H new ATOM 2414 N TYR A 155 12.939 -8.621 0.669 1.00 0.00 N ATOM 2415 CA TYR A 155 12.055 -8.857 1.801 1.00 0.00 C ATOM 2416 C TYR A 155 11.897 -10.352 2.058 1.00 0.00 C ATOM 2417 O TYR A 155 11.694 -10.781 3.193 1.00 0.00 O ATOM 2418 CB TYR A 155 10.685 -8.240 1.515 1.00 0.00 C ATOM 2419 CG TYR A 155 10.035 -7.559 2.700 1.00 0.00 C ATOM 2420 CD1 TYR A 155 10.435 -7.826 4.005 1.00 0.00 C ATOM 2421 CD2 TYR A 155 9.010 -6.646 2.503 1.00 0.00 C ATOM 2422 CE1 TYR A 155 9.829 -7.200 5.078 1.00 0.00 C ATOM 2423 CE2 TYR A 155 8.399 -6.016 3.567 1.00 0.00 C ATOM 2424 CZ TYR A 155 8.812 -6.295 4.853 1.00 0.00 C ATOM 2425 OH TYR A 155 8.205 -5.668 5.918 1.00 0.00 O ATOM 0 H TYR A 155 12.480 -8.200 -0.139 1.00 0.00 H new ATOM 0 HA TYR A 155 12.491 -8.396 2.687 1.00 0.00 H new ATOM 0 HB2 TYR A 155 10.791 -7.513 0.709 1.00 0.00 H new ATOM 0 HB3 TYR A 155 10.018 -9.023 1.153 1.00 0.00 H new ATOM 0 HD1 TYR A 155 11.231 -8.533 4.183 1.00 0.00 H new ATOM 0 HD2 TYR A 155 8.684 -6.424 1.498 1.00 0.00 H new ATOM 0 HE1 TYR A 155 10.149 -7.418 6.086 1.00 0.00 H new ATOM 0 HE2 TYR A 155 7.602 -5.308 3.394 1.00 0.00 H new ATOM 0 HH TYR A 155 8.848 -5.574 6.652 1.00 0.00 H new ATOM 2435 N ARG A 156 11.995 -11.141 0.992 1.00 0.00 N ATOM 2436 CA ARG A 156 11.865 -12.589 1.099 1.00 0.00 C ATOM 2437 C ARG A 156 13.224 -13.268 0.935 1.00 0.00 C ATOM 2438 O ARG A 156 13.620 -13.627 -0.174 1.00 0.00 O ATOM 2439 CB ARG A 156 10.892 -13.111 0.041 1.00 0.00 C ATOM 2440 CG ARG A 156 10.327 -14.486 0.358 1.00 0.00 C ATOM 2441 CD ARG A 156 11.055 -15.581 -0.405 1.00 0.00 C ATOM 2442 NE ARG A 156 10.137 -16.400 -1.195 1.00 0.00 N ATOM 2443 CZ ARG A 156 9.383 -17.371 -0.684 1.00 0.00 C ATOM 2444 NH1 ARG A 156 9.435 -17.649 0.613 1.00 0.00 N ATOM 2445 NH2 ARG A 156 8.576 -18.067 -1.472 1.00 0.00 N ATOM 0 H ARG A 156 12.164 -10.801 0.045 1.00 0.00 H new ATOM 0 HA ARG A 156 11.476 -12.825 2.090 1.00 0.00 H new ATOM 0 HB2 ARG A 156 10.069 -12.404 -0.063 1.00 0.00 H new ATOM 0 HB3 ARG A 156 11.402 -13.150 -0.922 1.00 0.00 H new ATOM 0 HG2 ARG A 156 10.406 -14.674 1.429 1.00 0.00 H new ATOM 0 HG3 ARG A 156 9.267 -14.511 0.107 1.00 0.00 H new ATOM 0 HD2 ARG A 156 11.798 -15.132 -1.063 1.00 0.00 H new ATOM 0 HD3 ARG A 156 11.594 -16.216 0.298 1.00 0.00 H new ATOM 0 HE ARG A 156 10.070 -16.217 -2.196 1.00 0.00 H new ATOM 0 HH11 ARG A 156 10.055 -17.117 1.224 1.00 0.00 H new ATOM 0 HH12 ARG A 156 8.855 -18.394 0.999 1.00 0.00 H new ATOM 0 HH21 ARG A 156 8.533 -17.859 -2.470 1.00 0.00 H new ATOM 0 HH22 ARG A 156 7.998 -18.811 -1.081 1.00 0.00 H new